0 B9R1.8 C=C=Cc1ccccn1 271570a_100015277604_100011216584 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.8 C=C=Cc1cccnc1 271570a_100015277604_100000752921 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.8 C=C=Cc1cnccn1 271570a_100015277604_100000758340 [0,0,0,0,0,0|1,0,2]=3 3 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.8 CC=Cc1cnccn1 271570a_100016259895_100000758340 [0,0,0,0,0,0|1,0,2]=3 6 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.8 CCNc1cccnn1 27a_100015525214_100016991348 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.8 CCNc1ccncn1 27a_100015525214_100000703185 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 CCNc1cnccn1 27a_100015525214_100000211759 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.8 CCNc1ncccn1 27a_100015525214_100000211032 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.8 CCOc1ccnnc1 34a_100015204005_100000210202 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.8 CCOc1cncnc1 7a_100000754086_100000210202 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.8 CCSc1cccnn1 62a_100000210202_100016991348 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.8 CCSc1cccnn1 62a_100016991348_100000210202 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.8 CCSc1ccncn1 62a_100000210202_100000703185 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.8 CCSc1ccncn1 62a_100000703185_100000210202 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.8 CCSc1ccnnc1 62a_100000210202_100000732662 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.8 CCSc1ccnnc1 62a_100000732662_100000210202 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.8 CCSc1cnccn1 62a_100000210202_100000211759 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.8 CCSc1cnccn1 62a_100000211759_100000210202 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.8 CCSc1cncnc1 62a_100000210202_100011206942 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.8 CCSc1cncnc1 62a_100011206942_100000210202 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.8 CCSc1ncccn1 62a_100000210202_100000211032 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.8 CCSc1ncccn1 62a_100000211032_100000210202 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [0,0,0,0,0,0|3,0,0]=3 44 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.8 CNCc1cccnn1 2230a_100159270163_200000210301 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.8 CNCc1cccnn1 2230a_106832991635_100016990269 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.8 CNCc1cccnn1 34a_100102657272_100016990269 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.8 CNCc1cccnn1 7a_106832991635_100016990269 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.8 CNCc1ccnnc1 270004a_106832991635_100011934578 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [0,0,0,0,0,0|2,0,0]=2 59 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [0,0,0,0,0,0|2,0,0]=2 60 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [0,0,0,0,0,0|2,0,0]=2 61 B9R1.8 CNCc1cncnc1 2230a_100011243677_200000210301 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.8 CNCc1cncnc1 2230a_106832991635_100015196519 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.8 CNCc1cncnc1 270004a_106832991635_100000749868 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.8 CNCc1cncnc1 34a_100102657272_100015196519 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.8 CNCc1cncnc1 7a_106832991635_100015196519 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.8 CNCc1ncccn1 2230a_106832991635_100000703007 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.8 CNCc1ncccn1 270004a_106832991635_100011532527 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.8 CNCc1ncccn1 34a_100102657272_100000703007 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.8 CNCc1ncccn1 7a_106832991635_100000703007 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.8 COCc1cccnn1 34a_100138415774_100016990269 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.8 COCc1cnccn1 34a_100138415774_100016995436 [0,0,0,0,0,0|2,0,0]=2 77 B9R1.8 COCc1cncnc1 34a_100138415774_100015196519 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.8 COCc1ncccn1 34a_100138415774_100000703007 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.8 CSCc1cccnn1 62a_100016990269_200000210301 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.8 CSCc1cccnn1 62a_200000210301_100016990269 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.8 CSCc1cnccn1 62a_100016995436_200000210301 [0,0,0,0,0,0|2,0,0]=2 88 B9R1.8 CSCc1cnccn1 62a_200000210301_100016995436 [0,0,0,0,0,0|2,0,0]=2 89 B9R1.8 CSCc1cncnc1 62a_100015196519_200000210301 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.8 CSCc1cncnc1 62a_200000210301_100015196519 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.8 CSCc1ncccn1 62a_100000703007_200000210301 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.8 CSCc1ncccn1 62a_200000210301_100000703007 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.8 FCOc1cccnc1 34a_100000210849_100015361967 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.8 FCOc1cccnc1 7a_100000210849_100015361967 [0,0,0,0,0,0|3,0,0]=3 98 B9R1.8 FCOc1ccnnc1 34a_100015204005_100015361967 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.8 FCOc1cncnc1 7a_100000754086_100015361967 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.8 FCSc1ccccn1 62a_100011216584_100015361967 [0,0,0,0,0,0|3,0,0]=3 103 B9R1.8 FCSc1ccccn1 62a_100015361967_100011216584 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.8 FCSc1cccnc1 62a_100000210063_100015361967 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.8 FCSc1cccnc1 62a_100015361967_100000210063 [0,0,0,0,0,0|3,0,0]=3 106 B9R1.8 FCSc1cccnn1 62a_100015361967_100016991348 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.8 FCSc1cccnn1 62a_100016991348_100015361967 [0,0,0,0,0,0|4,0,0]=4 108 B9R1.8 FCSc1ccncn1 62a_100000703185_100015361967 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.8 FCSc1ccncn1 62a_100015361967_100000703185 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.8 FCSc1ccnnc1 62a_100000732662_100015361967 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.8 FCSc1ccnnc1 62a_100015361967_100000732662 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.8 FCSc1cnccn1 62a_100000211759_100015361967 [0,0,0,0,0,0|2,0,0]=2 113 B9R1.8 FCSc1cnccn1 62a_100015361967_100000211759 [0,0,0,0,0,0|2,0,0]=2 114 B9R1.8 FCSc1cncnc1 62a_100011206942_100015361967 [0,0,0,0,0,0|4,0,0]=4 115 B9R1.8 FCSc1cncnc1 62a_100015361967_100011206942 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.8 FCSc1ncccn1 62a_100000211032_100015361967 [0,0,0,0,0,0|4,0,0]=4 117 B9R1.8 FCSc1ncccn1 62a_100015361967_100000211032 [0,0,0,0,0,0|4,0,0]=4 118 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [0,0,0,0,0,0|4,0,0]=4 119 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [0,0,0,0,0,0|4,0,0]=4 120 B9R1.8 [13CH3]NCc1cccnn1 2230a_100159270163_200025704644 [0,0,0,0,0,0|4,0,0]=4 121 B9R1.8 [13CH3]NCc1cncnc1 2230a_100011243677_200025704644 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [0,0,0,0,0,0|4,0,0]=4 123 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [0,0,0,0,0,0|4,0,0]=4 124 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [0,0,0,0,0,0|4,0,0]=4 125 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [0,0,0,0,0,0|3,0,0]=3 128 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [0,0,0,0,0,0|3,0,0]=3 129 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [0,0,0,0,0,0|3,0,0]=3 130 B9R1.8 [13CH3]SCc1cccnn1 62a_100016990269_200025704644 [0,0,0,0,0,0|4,0,0]=4 131 B9R1.8 [13CH3]SCc1cccnn1 62a_200025704644_100016990269 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.8 [13CH3]SCc1cnccn1 62a_100016995436_200025704644 [0,0,0,0,0,0|2,0,0]=2 133 B9R1.8 [13CH3]SCc1cnccn1 62a_200025704644_100016995436 [0,0,0,0,0,0|2,0,0]=2 134 B9R1.8 [13CH3]SCc1cncnc1 62a_100015196519_200025704644 [0,0,0,0,0,0|4,0,0]=4 135 B9R1.8 [13CH3]SCc1cncnc1 62a_200025704644_100015196519 [0,0,0,0,0,0|4,0,0]=4 136 B9R1.8 [13CH3]SCc1ncccn1 62a_100000703007_200025704644 [0,0,0,0,0,0|4,0,0]=4 137 B9R1.8 [13CH3]SCc1ncccn1 62a_200025704644_100000703007 [0,0,0,0,0,0|4,0,0]=4 138 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [1,0,0,0,0,0|1,0,2]=4 139 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [1,0,0,0,0,0|1,0,2]=4 140 B8R1.2 C=Cc1cnccn1 271570a_100011290941_100000758340 [1,0,0,0,0,0|0,0,2]=3 141 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.2 CNc1cccnn1 27a_100102657272_100016991348 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.2 CNc1ccncn1 27a_100102657272_100000703185 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.2 CNc1cnccn1 27a_100102657272_100000211759 [1,0,0,0,0,0|1,0,0]=2 145 B8R1.2 CNc1ncccn1 27a_100102657272_100000211032 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [1,0,0,0,0,0|2,0,0]=3 149 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [1,0,0,0,0,0|2,0,0]=3 150 B8R1.2 COc1ccnnc1 34a_100015204005_200000210301 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.2 COc1cncnc1 7a_100000754086_200000210301 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [1,0,0,0,0,0|2,0,0]=3 155 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [1,0,0,0,0,0|2,0,0]=3 156 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [1,0,0,0,0,0|2,0,0]=3 157 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.2 CSc1cccnn1 62a_100016991348_200000210301 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.2 CSc1cccnn1 62a_200000210301_100016991348 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.2 CSc1ccncn1 62a_100000703185_200000210301 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.2 CSc1ccncn1 62a_200000210301_100000703185 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.2 CSc1ccnnc1 62a_100000732662_200000210301 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.2 CSc1ccnnc1 62a_200000210301_100000732662 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.2 CSc1cnccn1 62a_100000211759_200000210301 [1,0,0,0,0,0|1,0,0]=2 165 B8R1.2 CSc1cnccn1 62a_200000210301_100000211759 [1,0,0,0,0,0|1,0,0]=2 166 B8R1.2 CSc1cncnc1 62a_100011206942_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.2 CSc1cncnc1 62a_200000210301_100011206942 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.2 CSc1ncccn1 62a_100000211032_200000210301 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.2 CSc1ncccn1 62a_200000210301_100000211032 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [1,0,0,0,0,0|2,0,0]=3 174 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [1,0,0,0,0,0|2,0,0]=3 175 B8R1.2 [13CH3]Oc1ccnnc1 34a_100015204005_200025704644 [1,0,0,0,0,0|3,0,0]=4 176 B8R1.2 [13CH3]Oc1cncnc1 7a_100000754086_200025704644 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [1,0,0,0,0,0|3,0,0]=4 178 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [1,0,0,0,0,0|2,0,0]=3 180 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [1,0,0,0,0,0|2,0,0]=3 181 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [1,0,0,0,0,0|2,0,0]=3 182 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [1,0,0,0,0,0|2,0,0]=3 183 B8R1.2 [13CH3]Sc1cccnn1 62a_100016991348_200025704644 [1,0,0,0,0,0|3,0,0]=4 184 B8R1.2 [13CH3]Sc1cccnn1 62a_200025704644_100016991348 [1,0,0,0,0,0|3,0,0]=4 185 B8R1.2 [13CH3]Sc1ccncn1 62a_100000703185_200025704644 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.2 [13CH3]Sc1ccncn1 62a_200025704644_100000703185 [1,0,0,0,0,0|3,0,0]=4 187 B8R1.2 [13CH3]Sc1ccnnc1 62a_100000732662_200025704644 [1,0,0,0,0,0|3,0,0]=4 188 B8R1.2 [13CH3]Sc1ccnnc1 62a_200025704644_100000732662 [1,0,0,0,0,0|3,0,0]=4 189 B8R1.2 [13CH3]Sc1cnccn1 62a_100000211759_200025704644 [1,0,0,0,0,0|1,0,0]=2 190 B8R1.2 [13CH3]Sc1cnccn1 62a_200025704644_100000211759 [1,0,0,0,0,0|1,0,0]=2 191 B8R1.2 [13CH3]Sc1cncnc1 62a_100011206942_200025704644 [1,0,0,0,0,0|3,0,0]=4 192 B8R1.2 [13CH3]Sc1cncnc1 62a_200025704644_100011206942 [1,0,0,0,0,0|3,0,0]=4 193 B8R1.2 [13CH3]Sc1ncccn1 62a_100000211032_200025704644 [1,0,0,0,0,0|3,0,0]=4 194 B8R1.2 [13CH3]Sc1ncccn1 62a_200025704644_100000211032 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.1 C=C=Cc1cnc(cn1)C 271570a_100015277604_100011999403 [0,1,0,0,0,0|1,0,2]=4 196 B10R1.1 C=C=Cc1cnc(cn1)F 271570a_100015277604_100009856528 [0,1,0,0,0,0|1,0,2]=4 197 B10R1.1 C=C=Cc1cnc(cn1)N 271570a_100015277604_100000761932 [0,1,0,0,0,0|1,0,2]=4 198 B10R1.1 CC=Cc1cnc(cn1)C 271570a_100016259895_100011999403 [0,1,0,0,0,0|1,0,2]=4 199 B10R1.1 CC=Cc1cnc(cn1)F 271570a_100016259895_100009856528 [0,1,0,0,0,0|1,0,2]=4 200 B10R1.1 CC=Cc1cnc(cn1)N 271570a_100016259895_100000761932 [0,1,0,0,0,0|1,0,2]=4 201 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.1 CCNc1ccc(cn1)Br 27a_100015525214_100000686858 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.1 CCNc1cnc(cn1)Br 27a_100015525214_100010187541 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.1 CCNc1cnc(cn1)C 27a_100015525214_100000074397 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.1 CCNc1cnc(cn1)F 27a_100015525214_100009856528 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.1 CCNc1cnc(nn1)N 27a_100015525214_100000691435 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.1 CCOc1ccc(cn1)C 34a_100000759353_100000210202 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.1 CCOc1ccc(cn1)Cl 34a_100011215309_100000210202 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.1 CCOc1ccc(cn1)F 34a_100000742473_100000210202 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.1 CCOc1ccc(cn1)N 34a_100000729260_100000210202 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.1 CCOc1ccc(nc1)Br 34a_100000685995_100000210202 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.1 CCOc1ccc(nc1)Br 7a_100000685995_100000210202 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.1 CCOc1ccc(nc1)Cl 34a_100000744096_100000210202 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.1 CCOc1ccc(nc1)Cl 7a_100000744096_100000210202 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.1 CCOc1ccc(nc1)F 34a_100000688820_100000210202 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.1 CCOc1ccc(nc1)F 7a_100000688820_100000210202 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.1 CCOc1ccc(nc1)I 34a_100000687607_100000210202 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.1 CCOc1ccc(nc1)I 7a_100000687607_100000210202 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.1 CCOc1ccc(nc1)N 34a_100015188713_100000210202 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.1 CCOc1ccc(nc1)N 7a_100015188713_100000210202 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.1 CCOc1cnc(cn1)Br 34a_100011934580_100000210202 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.1 CCOc1cnc(cn1)Cl 34a_100015839800_100000210202 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.1 CCOc1cnc(cn1)O 271570a_203496583355_200012356188 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.1 CCSc1ccc(cn1)Br 62a_100000210202_100000686858 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.1 CCSc1ccc(cn1)Br 62a_100000686858_100000210202 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.1 CCSc1ccc(cn1)C 62a_100000210202_100000754016 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.1 CCSc1ccc(cn1)C 62a_100011192072_100000210202 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.1 CCSc1ccc(cn1)Cl 62a_100000210202_100011356976 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.1 CCSc1ccc(cn1)Cl 62a_100011356976_100000210202 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.1 CCSc1ccc(cn1)F 62a_100000210202_100000744514 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.1 CCSc1ccc(cn1)F 62a_100000744514_100000210202 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.1 CCSc1ccc(cn1)N 62a_100000210202_100000737798 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.1 CCSc1ccc(cn1)N 62a_100000737798_100000210202 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.1 CCSc1ccc(nc1)Br 62a_100000210202_100009814638 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.1 CCSc1ccc(nc1)Br 62a_100009814638_100000210202 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000034144_100000210202 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000210202_100000034144 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.1 CCSc1ccc(nc1)F 62a_100000042367_100000210202 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.1 CCSc1ccc(nc1)F 62a_100000210202_100000042367 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.1 CCSc1ccc(nc1)N 62a_100000187370_100000210202 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.1 CCSc1ccc(nc1)N 62a_100000210202_100000187370 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.1 CCSc1cnc(cn1)Br 62a_100000210202_100010187541 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.1 CCSc1cnc(cn1)Br 62a_100010187541_100000210202 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.1 CCSc1cnc(cn1)C 62a_100000210202_100011999403 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.1 CCSc1cnc(cn1)C 62a_100011999403_100000210202 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.1 CCSc1cnc(cn1)Cl 62a_100000210202_100010214907 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.1 CCSc1cnc(cn1)Cl 62a_100010214907_100000210202 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.1 CCSc1cnc(cn1)F 62a_100000210202_100009856528 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.1 CCSc1cnc(cn1)F 62a_100009856528_100000210202 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.1 CCSc1cnc(cn1)N 62a_100000210202_100000744751 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.1 CCSc1cnc(cn1)N 62a_100000744751_100000210202 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.1 CCSc1cnc(cn1)O 62a_100000210202_100015839800 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.1 CCSc1cnc(cn1)O 62a_100011934580_100000210202 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.1 CCSc1cnc(nn1)N 62a_100000210202_100000691435 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.1 CCSc1cnc(nn1)N 62a_100000691435_100000210202 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.1 CNCc1cnc(cn1)C 2230a_106832991635_100000752025 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.1 CNCc1cnc(cn1)C 270004a_106832991635_100000685221 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.1 CNCc1cnc(cn1)C 34a_100132314150_200000210301 [0,1,0,0,0,0|2,0,0]=3 317 B10R1.1 CNCc1cnc(cn1)C 7a_106832991635_100000752025 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.1 CNCc1cnc(cn1)Cl 270004a_106832991635_100012001714 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.1 COCc1ccc(cn1)Br 34a_100000754261_200000210301 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.1 COCc1ccc(cn1)Br 34a_100138415774_100000702658 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.1 COCc1ccc(cn1)Cl 34a_100000703999_200000210301 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.1 COCc1ccc(cn1)Cl 34a_100138415774_100012066911 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.1 COCc1ccc(cn1)F 34a_100011999454_200000210301 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.1 COCc1ccc(cn1)F 34a_100138415774_100000703193 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.1 COCc1ccc(cn1)N 34a_100011998161_200000210301 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [0,1,0,0,0,0|3,0,0]=4 329 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [0,1,0,0,0,0|3,0,0]=4 339 B10R1.1 COCc1cnc(cn1)C 34a_100011273949_200000210301 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.1 COCc1cnc(cn1)Cl 34a_100012002382_200000210301 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.1 CSCc1ccc(cn1)Br 62a_100000702658_200000210301 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.1 CSCc1ccc(cn1)Br 62a_200000210301_100000702658 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.1 CSCc1ccc(cn1)Cl 62a_100012066911_200000210301 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.1 CSCc1ccc(cn1)Cl 62a_200000210301_100000697101 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.1 CSCc1ccc(cn1)F 62a_100000703193_200000210301 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.1 CSCc1ccc(cn1)F 62a_200000210301_100000703193 [0,1,0,0,0,0|3,0,0]=4 349 B10R1.1 CSCc1ccc(nc1)Br 62a_100009831999_200000210301 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.1 CSCc1ccc(nc1)Br 62a_200000210301_100009831999 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.1 CSCc1ccc(nc1)Cl 62a_100000735431_200000210301 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.1 CSCc1ccc(nc1)Cl 62a_200000210301_100000735431 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.1 CSCc1ccc(nc1)F 62a_100009820150_200000210301 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.1 CSCc1ccc(nc1)F 62a_200000210301_100000099788 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.1 CSCc1cnc(cn1)C 62a_100000752025_200000210301 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.1 CSCc1cnc(cn1)C 62a_200000210301_100000752025 [0,1,0,0,0,0|2,0,0]=3 360 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.1 Cc1ccc(cn1)OCF 34a_100000745506_100015361967 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.1 Cc1ccc(cn1)OCF 7a_100000745506_100015361967 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.1 Cc1ccc(cn1)SCF 62a_100000751577_100015361967 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.1 Cc1ccc(cn1)SCF 62a_100015361967_100000751577 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.1 Cc1ccc(nc1)OCF 34a_100000759353_100015361967 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.1 Cc1ccc(nc1)SCF 62a_100011192072_100015361967 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.1 Cc1ccc(nc1)SCF 62a_100015361967_100000754016 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.1 Cc1cnc(cn1)CN[13CH3] 34a_100132314150_200025704644 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.1 Cc1cnc(cn1)CO[13CH3] 34a_100011273949_200025704644 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.1 Cc1cnc(cn1)CS[13CH3] 62a_100000752025_200025704644 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.1 Cc1cnc(cn1)CS[13CH3] 62a_200025704644_100000752025 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.1 Cc1cnc(cn1)SCF 62a_100011999403_100015361967 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.1 Cc1cnc(cn1)SCF 62a_100015361967_100011999403 [0,1,0,0,0,0|2,0,0]=3 381 B10R1.1 FCOc1ccc(cn1)Cl 34a_100011215309_100015361967 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.1 FCOc1ccc(cn1)F 34a_100000742473_100015361967 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.1 FCOc1ccc(nc1)Br 34a_100000685995_100015361967 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.1 FCOc1ccc(nc1)Br 7a_100000685995_100015361967 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.1 FCOc1ccc(nc1)Cl 34a_100000744096_100015361967 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.1 FCOc1ccc(nc1)Cl 7a_100000744096_100015361967 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.1 FCOc1ccc(nc1)F 34a_100000688820_100015361967 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.1 FCOc1ccc(nc1)F 7a_100000688820_100015361967 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.1 FCOc1ccc(nc1)I 34a_100000687607_100015361967 [0,1,0,0,0,0|3,0,0]=4 390 B10R1.1 FCOc1ccc(nc1)I 7a_100000687607_100015361967 [0,1,0,0,0,0|3,0,0]=4 391 B10R1.1 FCOc1cnc(cn1)Br 34a_100011934580_100015361967 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.1 FCOc1cnc(cn1)Cl 34a_100015839800_100015361967 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.1 FCSc1ccc(cn1)Br 62a_100000686858_100015361967 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.1 FCSc1ccc(cn1)Br 62a_100015361967_100000686858 [0,1,0,0,0,0|3,0,0]=4 395 B10R1.1 FCSc1ccc(cn1)Cl 62a_100011356976_100015361967 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.1 FCSc1ccc(cn1)Cl 62a_100015361967_100011356976 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.1 FCSc1ccc(cn1)F 62a_100000744514_100015361967 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.1 FCSc1ccc(cn1)F 62a_100015361967_100000744514 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.1 FCSc1ccc(nc1)Br 62a_100009814638_100015361967 [0,1,0,0,0,0|3,0,0]=4 400 B10R1.1 FCSc1ccc(nc1)Br 62a_100015361967_100009814638 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.1 FCSc1ccc(nc1)Cl 62a_100000034144_100015361967 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.1 FCSc1ccc(nc1)Cl 62a_100015361967_100000034144 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.1 FCSc1ccc(nc1)F 62a_100000042367_100015361967 [0,1,0,0,0,0|3,0,0]=4 404 B10R1.1 FCSc1ccc(nc1)F 62a_100015361967_100000042367 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.1 FCSc1cnc(cn1)Br 62a_100010187541_100015361967 [0,1,0,0,0,0|2,0,0]=3 406 B10R1.1 FCSc1cnc(cn1)Br 62a_100015361967_100010187541 [0,1,0,0,0,0|2,0,0]=3 407 B10R1.1 FCSc1cnc(cn1)Cl 62a_100010214907_100015361967 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.1 FCSc1cnc(cn1)Cl 62a_100015361967_100010214907 [0,1,0,0,0,0|2,0,0]=3 409 B10R1.1 FCSc1cnc(cn1)F 62a_100009856528_100015361967 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.1 FCSc1cnc(cn1)F 62a_100015361967_100009856528 [0,1,0,0,0,0|2,0,0]=3 411 B10R1.1 N#CCc1ccc(cn1)O 271570a_203496583355_100011824422 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.1 N#CCc1ccc(nc1)O 271570a_203496583355_100000703598 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [0,1,0,0,0,0|3,0,0]=4 414 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.1 Nc1ccc(cn1)OCF 34a_100015188713_100015361967 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.1 Nc1ccc(cn1)OCF 7a_100015188713_100015361967 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.1 Nc1ccc(cn1)SCF 62a_100000187370_100015361967 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.1 Nc1ccc(cn1)SCF 62a_100015361967_100000187370 [0,1,0,0,0,0|3,0,0]=4 419 B10R1.1 Nc1ccc(nc1)OCF 34a_100000729260_100015361967 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.1 Nc1ccc(nc1)SCF 62a_100000737798_100015361967 [0,1,0,0,0,0|3,0,0]=4 421 B10R1.1 Nc1ccc(nc1)SCF 62a_100015361967_100000737798 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.1 Nc1cnc(cn1)SCF 62a_100000744751_100015361967 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.1 Nc1cnc(cn1)SCF 62a_100015361967_100000744751 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.1 Nc1ncc(nn1)SCF 62a_100000691435_100015361967 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.1 Nc1ncc(nn1)SCF 62a_100015361967_100000691435 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [0,1,0,0,0,0|2,1,0]=4 427 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [0,1,0,0,0,0|1,1,0]=3 428 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [0,1,0,0,0,0|1,1,0]=3 429 B10R1.1 Oc1ccc(nc1)SCF 62a_100000685995_100015361967 [0,1,0,0,0,0|3,0,0]=4 430 B10R1.1 Oc1ccc(nc1)SCF 62a_100015361967_100000744096 [0,1,0,0,0,0|3,0,0]=4 431 B10R1.1 Oc1cnc(cn1)SCF 62a_100011934580_100015361967 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.1 Oc1cnc(cn1)SCF 62a_100015361967_100015839800 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [0,1,0,0,0,0|3,0,0]=4 434 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [0,1,0,0,0,0|3,0,0]=4 436 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.1 [13CH3]OCc1ccc(cn1)Br 34a_100000754261_200025704644 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.1 [13CH3]OCc1ccc(cn1)Cl 34a_100000703999_200025704644 [0,1,0,0,0,0|3,0,0]=4 445 B10R1.1 [13CH3]OCc1ccc(cn1)F 34a_100011999454_200025704644 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.1 [13CH3]OCc1ccc(cn1)N 34a_100011998161_200025704644 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.1 [13CH3]OCc1cnc(cn1)Cl 34a_100012002382_200025704644 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_100000702658_200025704644 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_200025704644_100000702658 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_100012066911_200025704644 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_200025704644_100000697101 [0,1,0,0,0,0|3,0,0]=4 458 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_100000703193_200025704644 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_200025704644_100000703193 [0,1,0,0,0,0|3,0,0]=4 460 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_100009831999_200025704644 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_200025704644_100009831999 [0,1,0,0,0,0|3,0,0]=4 462 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_100000735431_200025704644 [0,1,0,0,0,0|3,0,0]=4 463 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_200025704644_100000735431 [0,1,0,0,0,0|3,0,0]=4 464 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_100009820150_200025704644 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_200025704644_100000099788 [0,1,0,0,0,0|3,0,0]=4 466 B10R1.4 C=C=Cc1nccnc1C 271570a_100015277604_100011999405 [0,1,0,0,0,0|1,0,2]=4 467 B10R1.4 C=C=Cc1nccnc1F 271570a_100015277604_200010125657 [0,1,0,0,0,0|1,0,2]=4 468 B10R1.4 C=C=Cc1nccnc1N 271570a_100015277604_100000747729 [0,1,0,0,0,0|1,0,2]=4 469 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [0,1,0,0,0,0|1,0,2]=4 470 B10R1.4 CC=Cc1nccnc1F 271570a_100016259895_200010125657 [0,1,0,0,0,0|1,0,2]=4 471 B10R1.4 CC=Cc1nccnc1N 271570a_100016259895_100000747729 [0,1,0,0,0,0|1,0,2]=4 472 B10R1.4 CCCc1ncncc1O 271570a_203496583355_100009816987 [0,1,0,0,0,0|3,0,0]=4 473 B10R1.4 CCNc1ncccc1Br 27a_100015525214_100000696092 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.4 CCNc1nccnc1C 27a_100015525214_100011999405 [0,1,0,0,0,0|2,0,0]=3 475 B10R1.4 CCNc1nccnc1F 27a_100015525214_200010125657 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [0,1,0,0,0,0|3,0,0]=4 477 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [0,1,0,0,0,0|3,0,0]=4 484 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.4 CCOc1nccnc1C 34a_100000766352_100000210202 [0,1,0,0,0,0|2,0,0]=3 499 B10R1.4 CCOc1nccnc1O 271570a_203496583355_200010128176 [0,1,0,0,0,0|2,0,0]=3 500 B10R1.4 CCSc1cccnc1Br 62a_100000210202_100010202626 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.4 CCSc1cccnc1Br 62a_100010202626_100000210202 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.4 CCSc1cccnc1C 62a_100000210202_100000751574 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.4 CCSc1cccnc1C 62a_100000751574_100000210202 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.4 CCSc1cccnc1Cl 62a_100000036424_100000210202 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.4 CCSc1cccnc1Cl 62a_100000210202_100000036424 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.4 CCSc1cccnc1F 62a_100000210202_100009816115 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.4 CCSc1cccnc1F 62a_100009816115_100000210202 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [0,1,0,0,0,0|3,0,0]=4 511 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [0,1,0,0,0,0|3,0,0]=4 512 B10R1.4 CCSc1cnccc1Br 62a_100000210202_100010138639 [0,1,0,0,0,0|3,0,0]=4 513 B10R1.4 CCSc1cnccc1Br 62a_100010138639_100000210202 [0,1,0,0,0,0|3,0,0]=4 514 B10R1.4 CCSc1cnccc1C 62a_100000210202_100000761580 [0,1,0,0,0,0|3,0,0]=4 515 B10R1.4 CCSc1cnccc1C 62a_100000761580_100000210202 [0,1,0,0,0,0|3,0,0]=4 516 B10R1.4 CCSc1cnccc1Cl 62a_100000210202_100009995489 [0,1,0,0,0,0|3,0,0]=4 517 B10R1.4 CCSc1cnccc1Cl 62a_100009995489_100000210202 [0,1,0,0,0,0|3,0,0]=4 518 B10R1.4 CCSc1cnccc1F 62a_100000210202_100009820683 [0,1,0,0,0,0|3,0,0]=4 519 B10R1.4 CCSc1cnccc1F 62a_100009820683_100000210202 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [0,1,0,0,0,0|3,0,0]=4 521 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [0,1,0,0,0,0|3,0,0]=4 522 B10R1.4 CCSc1ncc[nH]c1=O 62a_100000210202_100000763361 [0,1,0,0,0,0|2,0,1]=4 523 B10R1.4 CCSc1ncccc1Br 62a_100000210202_100000696092 [0,1,0,0,0,0|3,0,0]=4 524 B10R1.4 CCSc1ncccc1Br 62a_100000696092_100000210202 [0,1,0,0,0,0|3,0,0]=4 525 B10R1.4 CCSc1ncccc1C 62a_100000210202_100000751373 [0,1,0,0,0,0|3,0,0]=4 526 B10R1.4 CCSc1ncccc1C 62a_100000751373_100000210202 [0,1,0,0,0,0|3,0,0]=4 527 B10R1.4 CCSc1ncccc1Cl 62a_100000210202_100011356963 [0,1,0,0,0,0|3,0,0]=4 528 B10R1.4 CCSc1ncccc1Cl 62a_100011356963_100000210202 [0,1,0,0,0,0|3,0,0]=4 529 B10R1.4 CCSc1ncccc1F 62a_100000210202_100000685392 [0,1,0,0,0,0|3,0,0]=4 530 B10R1.4 CCSc1ncccc1F 62a_100000685392_100000210202 [0,1,0,0,0,0|3,0,0]=4 531 B10R1.4 CCSc1ncccc1N 62a_100000210202_100000688686 [0,1,0,0,0,0|3,0,0]=4 532 B10R1.4 CCSc1ncccc1N 62a_100000688686_100000210202 [0,1,0,0,0,0|3,0,0]=4 533 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [0,1,0,0,0,0|3,0,0]=4 534 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [0,1,0,0,0,0|3,0,0]=4 535 B10R1.4 CCSc1nccnc1C 62a_100000210202_100011999405 [0,1,0,0,0,0|2,0,0]=3 536 B10R1.4 CCSc1nccnc1C 62a_100011999405_100000210202 [0,1,0,0,0,0|2,0,0]=3 537 B10R1.4 CCSc1nccnc1Cl 62a_100000210202_100010886584 [0,1,0,0,0,0|2,0,0]=3 538 B10R1.4 CCSc1nccnc1Cl 62a_100010886584_100000210202 [0,1,0,0,0,0|2,0,0]=3 539 B10R1.4 CCSc1nccnc1F 62a_100000210202_200010125657 [0,1,0,0,0,0|2,0,0]=3 540 B10R1.4 CCSc1nccnc1F 62a_200010125657_100000210202 [0,1,0,0,0,0|2,0,0]=3 541 B10R1.4 CCSc1nccnc1N 62a_100000210202_100000747729 [0,1,0,0,0,0|2,0,0]=3 542 B10R1.4 CCSc1nccnc1N 62a_100000747729_100000210202 [0,1,0,0,0,0|2,0,0]=3 543 B10R1.4 CNCc1cccnc1Br 2230a_100009818023_200000210301 [0,1,0,0,0,0|3,0,0]=4 544 B10R1.4 CNCc1cccnc1Br 2230a_106832991635_100010140945 [0,1,0,0,0,0|3,0,0]=4 545 B10R1.4 CNCc1cccnc1Br 34a_100009818023_200000210301 [0,1,0,0,0,0|3,0,0]=4 546 B10R1.4 CNCc1cccnc1Br 34a_100102657272_100010140945 [0,1,0,0,0,0|3,0,0]=4 547 B10R1.4 CNCc1cccnc1Br 7a_106832991635_100010140945 [0,1,0,0,0,0|3,0,0]=4 548 B10R1.4 CNCc1cccnc1C 207a_100102657272_100000751968 [0,1,0,0,0,0|3,0,0]=4 549 B10R1.4 CNCc1cccnc1C 2230a_106832991635_100000732876 [0,1,0,0,0,0|3,0,0]=4 550 B10R1.4 CNCc1cccnc1C 270004a_106832991635_100000751968 [0,1,0,0,0,0|3,0,0]=4 551 B10R1.4 CNCc1cccnc1C 34a_100102657272_100000732876 [0,1,0,0,0,0|3,0,0]=4 552 B10R1.4 CNCc1cccnc1C 7a_106832991635_100000732876 [0,1,0,0,0,0|3,0,0]=4 553 B10R1.4 CNCc1cccnc1Cl 2230a_100015189234_200000210301 [0,1,0,0,0,0|3,0,0]=4 554 B10R1.4 CNCc1cccnc1Cl 2230a_106832991635_100000045678 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.4 CNCc1cccnc1Cl 34a_100015189234_200000210301 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.4 CNCc1cccnc1Cl 34a_100102657272_100000045678 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.4 CNCc1cccnc1Cl 7a_106832991635_100000045678 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.4 CNCc1cccnc1F 2230a_106832991635_100000099810 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.4 CNCc1cccnc1F 34a_100000724633_200000210301 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.4 CNCc1cccnc1F 34a_100102657272_100000099810 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.4 CNCc1cccnc1F 7a_106832991635_100000099810 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.4 CNCc1cnccc1Br 270004a_106832991635_100009816821 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.4 CNCc1cnccc1C 207a_100102657272_100000685662 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.4 CNCc1cnccc1C 2230a_106832991635_100000690890 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.4 CNCc1cnccc1C 270004a_106832991635_100000685662 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.4 CNCc1cnccc1C 34a_100102657272_100000690890 [0,1,0,0,0,0|3,0,0]=4 570 B10R1.4 CNCc1cnccc1C 7a_106832991635_100000690890 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.4 CNCc1cnccc1Cl 270004a_106832991635_100000050567 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.4 CNCc1ncccc1Br 207a_100102657272_100011934733 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.4 CNCc1ncccc1Br 2230a_106832991635_100025702911 [0,1,0,0,0,0|3,0,0]=4 574 B10R1.4 CNCc1ncccc1Br 270004a_106832991635_100011934733 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.4 CNCc1ncccc1Br 34a_100102657272_100025702911 [0,1,0,0,0,0|3,0,0]=4 576 B10R1.4 CNCc1ncccc1Br 7a_106832991635_100025702911 [0,1,0,0,0,0|3,0,0]=4 577 B10R1.4 CNCc1ncccc1C 207a_100102657272_100000698913 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.4 CNCc1ncccc1C 2230a_106832991635_100000696600 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.4 CNCc1ncccc1C 270004a_106832991635_100000698913 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.4 CNCc1ncccc1C 34a_100011223789_200000210301 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.4 CNCc1ncccc1C 34a_100102657272_100000696600 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.4 CNCc1ncccc1C 7a_106832991635_100000696600 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.4 CNCc1ncccc1Cl 207a_100102657272_100012001307 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.4 CNCc1ncccc1Cl 2230a_100015189233_200000210301 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.4 CNCc1ncccc1Cl 2230a_106832991635_100000099807 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.4 CNCc1ncccc1Cl 270004a_106832991635_100012001307 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.4 CNCc1ncccc1Cl 7a_106832991635_100000099807 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.4 CNCc1ncccc1F 207a_100102657272_100011934734 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.4 CNCc1ncccc1F 2230a_106832991635_100000104219 [0,1,0,0,0,0|3,0,0]=4 590 B10R1.4 CNCc1ncccc1F 270004a_106832991635_100011934734 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.4 CNCc1ncccc1F 34a_100000690088_200000210301 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.4 CNCc1ncccc1F 34a_100102657272_100000104219 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.4 CNCc1ncccc1F 7a_106832991635_100000104219 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [0,1,0,0,0,0|3,0,0]=4 595 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.4 CNCc1nccnc1C 2230a_100020641712_200000210301 [0,1,0,0,0,0|2,0,0]=3 597 B10R1.4 CNCc1nccnc1C 270004a_106832991635_100000050726 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.4 CNCc1nccnc1C 34a_100020641712_200000210301 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.4 CNCc1nccnc1Cl 2230a_100000729963_200000210301 [0,1,0,0,0,0|2,0,0]=3 600 B10R1.4 COCc1cccnc1Br 34a_100000719692_200000210301 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.4 COCc1cccnc1Br 34a_100138415774_100010140945 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.4 COCc1cccnc1Br 7a_100000719692_200000210301 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.4 COCc1cccnc1C 34a_100000729262_200000210301 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.4 COCc1cccnc1C 34a_100138415774_100000732876 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.4 COCc1cccnc1C 7a_100000729262_200000210301 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.4 COCc1cccnc1Cl 34a_100000748726_200000210301 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.4 COCc1cccnc1Cl 34a_100138415774_100000045678 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.4 COCc1cccnc1Cl 7a_100000748726_200000210301 [0,1,0,0,0,0|3,0,0]=4 609 B10R1.4 COCc1cccnc1F 34a_100000079888_200000210301 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.4 COCc1cccnc1F 34a_100138415774_100000099810 [0,1,0,0,0,0|3,0,0]=4 611 B10R1.4 COCc1cccnc1F 7a_100000079888_200000210301 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.4 COCc1cnccc1C 34a_100011996381_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.4 COCc1cnccc1C 34a_100138415774_100000690890 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.4 COCc1cnccc1Cl 34a_100000117392_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B10R1.4 COCc1ncccc1Br 34a_100011996772_200000210301 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.4 COCc1ncccc1Br 34a_100138415774_100025702911 [0,1,0,0,0,0|3,0,0]=4 617 B10R1.4 COCc1ncccc1C 34a_100000698912_200000210301 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.4 COCc1ncccc1C 34a_100138415774_100000696600 [0,1,0,0,0,0|3,0,0]=4 619 B10R1.4 COCc1ncccc1Cl 34a_100012002383_200000210301 [0,1,0,0,0,0|3,0,0]=4 620 B10R1.4 COCc1ncccc1F 34a_100011934865_200000210301 [0,1,0,0,0,0|3,0,0]=4 621 B10R1.4 COCc1ncccc1F 34a_100138415774_100000104219 [0,1,0,0,0,0|3,0,0]=4 622 B10R1.4 COCc1ncccc1N 34a_114873767017_200000210301 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [0,1,0,0,0,0|3,0,0]=4 624 B10R1.4 COCc1nccnc1Cl 34a_100000057004_200000210301 [0,1,0,0,0,0|2,0,0]=3 625 B10R1.4 CSCc1cccnc1Br 62a_100010140945_200000210301 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.4 CSCc1cccnc1Br 62a_200000210301_100010140945 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.4 CSCc1cccnc1C 62a_100000732876_200000210301 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.4 CSCc1cccnc1C 62a_200000210301_100000732876 [0,1,0,0,0,0|3,0,0]=4 629 B10R1.4 CSCc1cccnc1Cl 62a_100000045678_200000210301 [0,1,0,0,0,0|3,0,0]=4 630 B10R1.4 CSCc1cccnc1Cl 62a_200000210301_100000045678 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.4 CSCc1cccnc1F 62a_100000099810_200000210301 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.4 CSCc1cccnc1F 62a_200000210301_100000099810 [0,1,0,0,0,0|3,0,0]=4 633 B10R1.4 CSCc1cnccc1C 62a_100000690890_200000210301 [0,1,0,0,0,0|3,0,0]=4 634 B10R1.4 CSCc1cnccc1C 62a_200000210301_100000690890 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.4 CSCc1ncccc1Br 62a_100025702911_200000210301 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.4 CSCc1ncccc1Br 62a_200000210301_100025702911 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.4 CSCc1ncccc1C 62a_100000696600_200000210301 [0,1,0,0,0,0|3,0,0]=4 638 B10R1.4 CSCc1ncccc1C 62a_200000210301_100000696600 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.4 CSCc1ncccc1Cl 62a_100000099807_200000210301 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.4 CSCc1ncccc1Cl 62a_200000210301_100000099807 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.4 CSCc1ncccc1F 62a_100000104219_200000210301 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.4 CSCc1ncccc1F 62a_200000210301_100000104219 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.4 Cc1cccnc1CN[13CH3] 34a_100011223789_200025704644 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.4 Cc1cccnc1CO[13CH3] 34a_100000698912_200025704644 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.4 Cc1cccnc1CS[13CH3] 62a_100000696600_200025704644 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.4 Cc1cccnc1CS[13CH3] 62a_200025704644_100000696600 [0,1,0,0,0,0|3,0,0]=4 649 B10R1.4 Cc1cccnc1SCF 62a_100000751373_100015361967 [0,1,0,0,0,0|3,0,0]=4 650 B10R1.4 Cc1cccnc1SCF 62a_100015361967_100000751373 [0,1,0,0,0,0|3,0,0]=4 651 B10R1.4 Cc1ccncc1CO[13CH3] 34a_100011996381_200025704644 [0,1,0,0,0,0|3,0,0]=4 652 B10R1.4 Cc1ccncc1CS[13CH3] 62a_100000690890_200025704644 [0,1,0,0,0,0|3,0,0]=4 653 B10R1.4 Cc1ccncc1CS[13CH3] 62a_200025704644_100000690890 [0,1,0,0,0,0|3,0,0]=4 654 B10R1.4 Cc1ccncc1OCF 34a_100011997053_100015361967 [0,1,0,0,0,0|3,0,0]=4 655 B10R1.4 Cc1ccncc1OCF 7a_100011997053_100015361967 [0,1,0,0,0,0|3,0,0]=4 656 B10R1.4 Cc1ccncc1SCF 62a_100000761580_100015361967 [0,1,0,0,0,0|3,0,0]=4 657 B10R1.4 Cc1ccncc1SCF 62a_100015361967_100000761580 [0,1,0,0,0,0|3,0,0]=4 658 B10R1.4 Cc1ncccc1CO[13CH3] 34a_100000729262_200025704644 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.4 Cc1ncccc1CO[13CH3] 7a_100000729262_200025704644 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.4 Cc1ncccc1CS[13CH3] 62a_100000732876_200025704644 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.4 Cc1ncccc1CS[13CH3] 62a_200025704644_100000732876 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.4 Cc1ncccc1OCF 34a_100000745507_100015361967 [0,1,0,0,0,0|3,0,0]=4 663 B10R1.4 Cc1ncccc1OCF 7a_100000745507_100015361967 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.4 Cc1ncccc1SCF 62a_100000751574_100015361967 [0,1,0,0,0,0|3,0,0]=4 665 B10R1.4 Cc1ncccc1SCF 62a_100015361967_100000751574 [0,1,0,0,0,0|3,0,0]=4 666 B10R1.4 Cc1nccnc1CN[13CH3] 2230a_100020641712_200025704644 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.4 Cc1nccnc1CN[13CH3] 34a_100020641712_200025704644 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.4 Cc1nccnc1OCF 34a_100000766352_100015361967 [0,1,0,0,0,0|2,0,0]=3 669 B10R1.4 Cc1nccnc1SCF 62a_100011999405_100015361967 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.4 Cc1nccnc1SCF 62a_100015361967_100011999405 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.4 FCOc1cccnc1Br 34a_100000744436_100015361967 [0,1,0,0,0,0|3,0,0]=4 672 B10R1.4 FCOc1cccnc1Br 7a_100000744436_100015361967 [0,1,0,0,0,0|3,0,0]=4 673 B10R1.4 FCOc1cccnc1Cl 34a_100000757616_100015361967 [0,1,0,0,0,0|3,0,0]=4 674 B10R1.4 FCOc1cccnc1Cl 7a_100000757616_100015361967 [0,1,0,0,0,0|3,0,0]=4 675 B10R1.4 FCOc1cccnc1F 34a_100000061740_100015361967 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.4 FCOc1cccnc1F 7a_100000061740_100015361967 [0,1,0,0,0,0|3,0,0]=4 677 B10R1.4 FCOc1cccnc1I 34a_100000034122_100015361967 [0,1,0,0,0,0|3,0,0]=4 678 B10R1.4 FCOc1cccnc1I 7a_100000034122_100015361967 [0,1,0,0,0,0|3,0,0]=4 679 B10R1.4 FCOc1cnccc1Cl 34a_100011996695_100015361967 [0,1,0,0,0,0|3,0,0]=4 680 B10R1.4 FCOc1cnccc1I 34a_100000050107_100015361967 [0,1,0,0,0,0|3,0,0]=4 681 B10R1.4 FCOc1ncccc1Cl 34a_100011290957_100015361967 [0,1,0,0,0,0|3,0,0]=4 682 B10R1.4 FCOc1ncccc1F 34a_100011219419_100015361967 [0,1,0,0,0,0|3,0,0]=4 683 B10R1.4 FCSc1cccnc1Br 62a_100010202626_100015361967 [0,1,0,0,0,0|3,0,0]=4 684 B10R1.4 FCSc1cccnc1Br 62a_100015361967_100010202626 [0,1,0,0,0,0|3,0,0]=4 685 B10R1.4 FCSc1cccnc1Cl 62a_100000036424_100015361967 [0,1,0,0,0,0|3,0,0]=4 686 B10R1.4 FCSc1cccnc1Cl 62a_100015361967_100000036424 [0,1,0,0,0,0|3,0,0]=4 687 B10R1.4 FCSc1cccnc1F 62a_100009816115_100015361967 [0,1,0,0,0,0|3,0,0]=4 688 B10R1.4 FCSc1cccnc1F 62a_100015361967_100009816115 [0,1,0,0,0,0|3,0,0]=4 689 B10R1.4 FCSc1cnccc1Br 62a_100010138639_100015361967 [0,1,0,0,0,0|3,0,0]=4 690 B10R1.4 FCSc1cnccc1Br 62a_100015361967_100010138639 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.4 FCSc1cnccc1Cl 62a_100009995489_100015361967 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.4 FCSc1cnccc1Cl 62a_100015361967_100009995489 [0,1,0,0,0,0|3,0,0]=4 693 B10R1.4 FCSc1cnccc1F 62a_100009820683_100015361967 [0,1,0,0,0,0|3,0,0]=4 694 B10R1.4 FCSc1cnccc1F 62a_100015361967_100009820683 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.4 FCSc1ncccc1Br 62a_100000696092_100015361967 [0,1,0,0,0,0|3,0,0]=4 696 B10R1.4 FCSc1ncccc1Br 62a_100015361967_100000696092 [0,1,0,0,0,0|3,0,0]=4 697 B10R1.4 FCSc1ncccc1Cl 62a_100011356963_100015361967 [0,1,0,0,0,0|3,0,0]=4 698 B10R1.4 FCSc1ncccc1Cl 62a_100015361967_100011356963 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.4 FCSc1ncccc1F 62a_100000685392_100015361967 [0,1,0,0,0,0|3,0,0]=4 700 B10R1.4 FCSc1ncccc1F 62a_100015361967_100000685392 [0,1,0,0,0,0|3,0,0]=4 701 B10R1.4 FCSc1nccnc1Cl 62a_100010886584_100015361967 [0,1,0,0,0,0|2,0,0]=3 702 B10R1.4 FCSc1nccnc1Cl 62a_100015361967_100010886584 [0,1,0,0,0,0|2,0,0]=3 703 B10R1.4 FCSc1nccnc1F 62a_100015361967_200010125657 [0,1,0,0,0,0|2,0,0]=3 704 B10R1.4 FCSc1nccnc1F 62a_200010125657_100015361967 [0,1,0,0,0,0|2,0,0]=3 705 B10R1.4 N#CCc1cccnc1O 271570a_203496583355_100000096391 [0,1,0,0,0,0|2,0,1]=4 706 B10R1.4 N#CCc1ncccc1O 271570a_203496583355_100011824415 [0,1,0,0,0,0|2,0,1]=4 707 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.4 Nc1cccnc1OCF 34a_100000746358_100015361967 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.4 Nc1cccnc1SCF 62a_100000688686_100015361967 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.4 Nc1cccnc1SCF 62a_100015361967_100000688686 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.4 Nc1ccncc1OCF 34a_100000753702_100015361967 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.4 Nc1ccncc1SCF 62a_100000047001_100015361967 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.4 Nc1ccncc1SCF 62a_100015361967_100000047001 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.4 Nc1ncccc1OCF 34a_100000211975_100015361967 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.4 Nc1ncccc1OCF 7a_100000211975_100015361967 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.4 Nc1ncccc1SCF 62a_100000045569_100015361967 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.4 Nc1ncccc1SCF 62a_100015361967_100000045569 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.4 Nc1nccnc1SCF 62a_100000747729_100015361967 [0,1,0,0,0,0|2,0,0]=3 719 B10R1.4 Nc1nccnc1SCF 62a_100015361967_100000747729 [0,1,0,0,0,0|2,0,0]=3 720 B10R1.4 O=c1[nH]ccnc1SCF 62a_100015361967_100000763361 [0,1,0,0,0,0|2,0,1]=4 721 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [0,1,0,0,0,0|2,1,0]=4 722 B10R1.4 Oc1cccnc1SCF 62a_100000034122_100015361967 [0,1,0,0,0,0|3,0,0]=4 723 B10R1.4 Oc1cccnc1SCF 62a_100015361967_100000034122 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.4 Oc1ncccc1SCF 62a_100000760158_100015361967 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.4 Oc1ncccc1SCF 62a_100015361967_100000760158 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.4 [13CH3]NCc1cccnc1Br 2230a_100009818023_200025704644 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.4 [13CH3]NCc1cccnc1Br 34a_100009818023_200025704644 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.4 [13CH3]NCc1cccnc1Cl 2230a_100015189234_200025704644 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.4 [13CH3]NCc1cccnc1Cl 34a_100015189234_200025704644 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.4 [13CH3]NCc1cccnc1F 34a_100000724633_200025704644 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.4 [13CH3]NCc1ncccc1Cl 2230a_100015189233_200025704644 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.4 [13CH3]NCc1ncccc1F 34a_100000690088_200025704644 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.4 [13CH3]NCc1nccnc1Cl 2230a_100000729963_200025704644 [0,1,0,0,0,0|2,0,0]=3 734 B10R1.4 [13CH3]OCc1cccnc1Br 34a_100000719692_200025704644 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.4 [13CH3]OCc1cccnc1Br 7a_100000719692_200025704644 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.4 [13CH3]OCc1cccnc1Cl 34a_100000748726_200025704644 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.4 [13CH3]OCc1cccnc1Cl 7a_100000748726_200025704644 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.4 [13CH3]OCc1cccnc1F 34a_100000079888_200025704644 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.4 [13CH3]OCc1cccnc1F 7a_100000079888_200025704644 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.4 [13CH3]OCc1cnccc1Cl 34a_100000117392_200025704644 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.4 [13CH3]OCc1ncccc1Br 34a_100011996772_200025704644 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.4 [13CH3]OCc1ncccc1Cl 34a_100012002383_200025704644 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.4 [13CH3]OCc1ncccc1F 34a_100011934865_200025704644 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.4 [13CH3]OCc1ncccc1N 34a_114873767017_200025704644 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.4 [13CH3]OCc1nccnc1Cl 34a_100000057004_200025704644 [0,1,0,0,0,0|2,0,0]=3 746 B10R1.4 [13CH3]SCc1cccnc1Br 62a_100010140945_200025704644 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.4 [13CH3]SCc1cccnc1Br 62a_200025704644_100010140945 [0,1,0,0,0,0|3,0,0]=4 748 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_100000045678_200025704644 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_200025704644_100000045678 [0,1,0,0,0,0|3,0,0]=4 750 B10R1.4 [13CH3]SCc1cccnc1F 62a_100000099810_200025704644 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.4 [13CH3]SCc1cccnc1F 62a_200025704644_100000099810 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.4 [13CH3]SCc1ncccc1Br 62a_100025702911_200025704644 [0,1,0,0,0,0|3,0,0]=4 753 B10R1.4 [13CH3]SCc1ncccc1Br 62a_200025704644_100025702911 [0,1,0,0,0,0|3,0,0]=4 754 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_100000099807_200025704644 [0,1,0,0,0,0|3,0,0]=4 755 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_200025704644_100000099807 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.4 [13CH3]SCc1ncccc1F 62a_100000104219_200025704644 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.4 [13CH3]SCc1ncccc1F 62a_200025704644_100000104219 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.10 C=C=Cc1cncc(n1)C 271570a_100015277604_100009842155 [0,1,0,0,0,0|1,0,2]=4 761 B10R1.10 C=C=Cc1cncc(n1)F 271570a_100015277604_200009863489 [0,1,0,0,0,0|1,0,2]=4 762 B10R1.10 C=C=Cc1cncc(n1)N 271570a_100015277604_100009819714 [0,1,0,0,0,0|1,0,2]=4 763 B10R1.10 C=C=Cc1cncc(n1)O 271570a_100015277604_100011269956 [0,1,0,0,0,0|1,0,2]=4 764 B10R1.10 CC=Cc1cncc(n1)C 271570a_100016259895_100009842155 [0,1,0,0,0,0|1,0,2]=4 765 B10R1.10 CC=Cc1cncc(n1)F 271570a_100016259895_200009863489 [0,1,0,0,0,0|1,0,2]=4 766 B10R1.10 CC=Cc1cncc(n1)N 271570a_100016259895_100009819714 [0,1,0,0,0,0|1,0,2]=4 767 B10R1.10 CC=Cc1cncc(n1)O 271570a_100016259895_100011269956 [0,1,0,0,0,0|1,0,2]=4 768 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [0,1,0,0,0,0|3,0,0]=4 769 B10R1.10 CCNc1c[n+](ccn1)[O-] 27a_100015525214_100009880115 [0,1,0,0,0,0|2,0,1]=4 770 B10R1.10 CCNc1cc(ccn1)F 27a_100015525214_100000764206 [0,1,0,0,0,0|3,0,0]=4 771 B10R1.10 CCNc1cccc(n1)F 27a_100015525214_100009815982 [0,1,0,0,0,0|3,0,0]=4 772 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [0,1,0,0,0,0|3,0,0]=4 773 B10R1.10 CCNc1cncc(n1)C 27a_100015525214_100000754123 [0,1,0,0,0,0|2,0,0]=3 774 B10R1.10 CCNc1cncc(n1)Cl 27a_100015525214_100010892449 [0,1,0,0,0,0|2,0,0]=3 775 B10R1.10 CCNc1cncc(n1)F 27a_100015525214_200009863489 [0,1,0,0,0,0|2,0,0]=3 776 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [0,1,0,0,0,0|3,0,0]=4 777 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [0,1,0,0,0,0|3,0,0]=4 778 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [0,1,0,0,0,0|3,0,0]=4 779 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [0,1,0,0,0,0|3,0,0]=4 780 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.10 CCOc1cncc(n1)O 271570a_203496583355_100000757043 [0,1,0,0,0,0|2,0,0]=3 789 B10R1.10 CCSc1c[n+](ccn1)[O-] 62a_100000210202_100009880115 [0,1,0,0,0,0|2,0,1]=4 790 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [0,1,0,0,0,0|3,0,0]=4 792 B10R1.10 CCSc1cc(ccn1)Cl 62a_100000210202_100010167805 [0,1,0,0,0,0|3,0,0]=4 793 B10R1.10 CCSc1cc(ccn1)Cl 62a_100010167805_100000210202 [0,1,0,0,0,0|3,0,0]=4 794 B10R1.10 CCSc1cc(ccn1)F 62a_100000210202_100000764206 [0,1,0,0,0,0|3,0,0]=4 795 B10R1.10 CCSc1cc(ccn1)F 62a_100000764206_100000210202 [0,1,0,0,0,0|3,0,0]=4 796 B10R1.10 CCSc1cc(ccn1)N 62a_100000210202_100009814236 [0,1,0,0,0,0|3,0,0]=4 797 B10R1.10 CCSc1cc(ccn1)N 62a_100009814236_100000210202 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.10 CCSc1cccc(n1)Br 62a_100000210202_100000684672 [0,1,0,0,0,0|3,0,0]=4 800 B10R1.10 CCSc1cccc(n1)Br 62a_100000684672_100000210202 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [0,1,0,0,0,0|3,0,0]=4 802 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.10 CCSc1cccc(n1)Cl 62a_100000051397_100000210202 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.10 CCSc1cccc(n1)Cl 62a_100000210202_100000051397 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.10 CCSc1cccc(n1)F 62a_100000210202_100009815982 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.10 CCSc1cccc(n1)F 62a_100009815982_100000210202 [0,1,0,0,0,0|3,0,0]=4 807 B10R1.10 CCSc1cccc(n1)N 62a_100000210202_100000740741 [0,1,0,0,0,0|3,0,0]=4 808 B10R1.10 CCSc1cccc(n1)N 62a_100000740741_100000210202 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.10 CCSc1cncc(c1)Br 62a_100000210202_100000728054 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.10 CCSc1cncc(c1)Br 62a_100000728054_100000210202 [0,1,0,0,0,0|3,0,0]=4 811 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.10 CCSc1cncc(c1)Cl 62a_100000049639_100000210202 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.10 CCSc1cncc(c1)Cl 62a_100000210202_100000049639 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.10 CCSc1cncc(c1)F 62a_100000210202_100000744099 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.10 CCSc1cncc(c1)F 62a_100000744099_100000210202 [0,1,0,0,0,0|3,0,0]=4 817 B10R1.10 CCSc1cncc(c1)N 62a_100000210202_100000687067 [0,1,0,0,0,0|3,0,0]=4 818 B10R1.10 CCSc1cncc(c1)N 62a_100000687067_100000210202 [0,1,0,0,0,0|3,0,0]=4 819 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.10 CCSc1cncc(n1)C 62a_100000210202_100000754123 [0,1,0,0,0,0|2,0,0]=3 822 B10R1.10 CCSc1cncc(n1)C 62a_100000754123_100000210202 [0,1,0,0,0,0|2,0,0]=3 823 B10R1.10 CCSc1cncc(n1)Cl 62a_100000210202_100010892449 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.10 CCSc1cncc(n1)Cl 62a_100010892449_100000210202 [0,1,0,0,0,0|2,0,0]=3 825 B10R1.10 CCSc1cncc(n1)F 62a_100000210202_200009863489 [0,1,0,0,0,0|2,0,0]=3 826 B10R1.10 CCSc1cncc(n1)F 62a_200009863489_100000210202 [0,1,0,0,0,0|2,0,0]=3 827 B10R1.10 CCSc1cncc(n1)N 62a_100000210202_100000747728 [0,1,0,0,0,0|2,0,0]=3 828 B10R1.10 CCSc1cncc(n1)N 62a_100000747728_100000210202 [0,1,0,0,0,0|2,0,0]=3 829 B10R1.10 CCSc1cncc(n1)O 62a_100000210202_100011269956 [0,1,0,0,0,0|2,0,0]=3 830 B10R1.10 CNCc1cc(ccn1)Br 2230a_106832991635_100010173614 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.10 CNCc1cc(ccn1)Br 270004a_106832991635_100009818557 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.10 CNCc1cc(ccn1)Br 34a_100102657272_100010173614 [0,1,0,0,0,0|3,0,0]=4 833 B10R1.10 CNCc1cc(ccn1)Br 7a_106832991635_100010173614 [0,1,0,0,0,0|3,0,0]=4 834 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [0,1,0,0,0,0|3,0,0]=4 836 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [0,1,0,0,0,0|3,0,0]=4 837 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [0,1,0,0,0,0|3,0,0]=4 838 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [0,1,0,0,0,0|3,0,0]=4 839 B10R1.10 CNCc1cc(ccn1)Cl 2230a_106832991635_100016988179 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.10 CNCc1cc(ccn1)Cl 270004a_106832991635_100011998288 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.10 CNCc1cc(ccn1)Cl 34a_100102657272_100016988179 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.10 CNCc1cc(ccn1)Cl 7a_106832991635_100016988179 [0,1,0,0,0,0|3,0,0]=4 843 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [0,1,0,0,0,0|3,0,0]=4 844 B10R1.10 CNCc1cccc(n1)Br 2230a_100016987751_200000210301 [0,1,0,0,0,0|3,0,0]=4 845 B10R1.10 CNCc1cccc(n1)Br 2230a_106832991635_100009889011 [0,1,0,0,0,0|3,0,0]=4 846 B10R1.10 CNCc1cccc(n1)Br 270004a_106832991635_100000688028 [0,1,0,0,0,0|3,0,0]=4 847 B10R1.10 CNCc1cccc(n1)Br 34a_100102657272_100009889011 [0,1,0,0,0,0|3,0,0]=4 848 B10R1.10 CNCc1cccc(n1)Br 7a_106832991635_100009889011 [0,1,0,0,0,0|3,0,0]=4 849 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.10 CNCc1cccc(n1)Cl 2230a_100016990191_200000210301 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.10 CNCc1cccc(n1)Cl 2230a_106832991635_100000086093 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.10 CNCc1cccc(n1)Cl 270004a_106832991635_100011361687 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.10 CNCc1cccc(n1)Cl 34a_100102657272_100000086093 [0,1,0,0,0,0|3,0,0]=4 859 B10R1.10 CNCc1cccc(n1)Cl 7a_106832991635_100000086093 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.10 CNCc1cccc(n1)F 2230a_100015188798_200000210301 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.10 CNCc1cccc(n1)F 2230a_106832991635_100009819644 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.10 CNCc1cccc(n1)F 270004a_106832991635_100000050434 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.10 CNCc1cccc(n1)F 34a_100015188798_200000210301 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.10 CNCc1cccc(n1)F 34a_100102657272_100009819644 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.10 CNCc1cccc(n1)F 7a_106832991635_100009819644 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.10 CNCc1cncc(c1)Br 207a_100102657272_100000687066 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.10 CNCc1cncc(c1)Br 2230a_106832991635_100000738771 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.10 CNCc1cncc(c1)Br 270004a_106832991635_100000687066 [0,1,0,0,0,0|3,0,0]=4 870 B10R1.10 CNCc1cncc(c1)Br 34a_100102657272_100000738771 [0,1,0,0,0,0|3,0,0]=4 871 B10R1.10 CNCc1cncc(c1)Br 7a_106832991635_100000738771 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [0,1,0,0,0,0|3,0,0]=4 873 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [0,1,0,0,0,0|3,0,0]=4 874 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [0,1,0,0,0,0|3,0,0]=4 875 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [0,1,0,0,0,0|3,0,0]=4 876 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [0,1,0,0,0,0|3,0,0]=4 877 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [0,1,0,0,0,0|3,0,0]=4 878 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [0,1,0,0,0,0|3,0,0]=4 879 B10R1.10 CNCc1cncc(c1)Cl 207a_100102657272_100000088910 [0,1,0,0,0,0|3,0,0]=4 880 B10R1.10 CNCc1cncc(c1)Cl 2230a_106832991635_100016992070 [0,1,0,0,0,0|3,0,0]=4 881 B10R1.10 CNCc1cncc(c1)Cl 2230a_200020614424_200000210301 [0,1,0,0,0,0|3,0,0]=4 882 B10R1.10 CNCc1cncc(c1)Cl 270004a_106832991635_100000088910 [0,1,0,0,0,0|3,0,0]=4 883 B10R1.10 CNCc1cncc(c1)Cl 34a_100102657272_100016992070 [0,1,0,0,0,0|3,0,0]=4 884 B10R1.10 CNCc1cncc(c1)Cl 7a_106832991635_100016992070 [0,1,0,0,0,0|3,0,0]=4 885 B10R1.10 CNCc1cncc(c1)F 207a_100102657272_100011361476 [0,1,0,0,0,0|3,0,0]=4 886 B10R1.10 CNCc1cncc(c1)F 2230a_100011962886_200000210301 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.10 CNCc1cncc(c1)F 2230a_106832991635_100000725299 [0,1,0,0,0,0|3,0,0]=4 888 B10R1.10 CNCc1cncc(c1)F 270004a_106832991635_100011361476 [0,1,0,0,0,0|3,0,0]=4 889 B10R1.10 CNCc1cncc(c1)F 34a_100011962886_200000210301 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.10 CNCc1cncc(c1)F 34a_100102657272_100000725299 [0,1,0,0,0,0|3,0,0]=4 891 B10R1.10 CNCc1cncc(c1)F 7a_106832991635_100000725299 [0,1,0,0,0,0|3,0,0]=4 892 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [0,1,0,0,0,0|3,0,0]=4 894 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [0,1,0,0,0,0|3,0,0]=4 895 B10R1.10 CNCc1cncc(n1)C 207a_100102657272_100000100294 [0,1,0,0,0,0|2,0,0]=3 896 B10R1.10 CNCc1cncc(n1)C 270004a_106832991635_100000100294 [0,1,0,0,0,0|2,0,0]=3 897 B10R1.10 COCc1cc(ccn1)Br 34a_100138415774_100010173614 [0,1,0,0,0,0|3,0,0]=4 898 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [0,1,0,0,0,0|3,0,0]=4 899 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [0,1,0,0,0,0|3,0,0]=4 900 B10R1.10 COCc1cc(ccn1)Cl 34a_100000748867_200000210301 [0,1,0,0,0,0|3,0,0]=4 901 B10R1.10 COCc1cc(ccn1)Cl 34a_100138415774_100016988179 [0,1,0,0,0,0|3,0,0]=4 902 B10R1.10 COCc1cc(ccn1)N 34a_100000692640_200000210301 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.10 COCc1cccc(n1)Br 34a_100000694195_200000210301 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.10 COCc1cccc(n1)Br 34a_100138415774_100009889011 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.10 COCc1cccc(n1)Cl 34a_100011998359_200000210301 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.10 COCc1cccc(n1)Cl 34a_100138415774_100000086093 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.10 COCc1cccc(n1)F 34a_100000086748_200000210301 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.10 COCc1cccc(n1)F 34a_100138415774_100009819644 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.10 COCc1cncc(c1)Br 34a_100011259137_200000210301 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.10 COCc1cncc(c1)Br 34a_100138415774_100000738771 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.10 COCc1cncc(c1)Br 7a_100011259137_200000210301 [0,1,0,0,0,0|3,0,0]=4 914 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [0,1,0,0,0,0|3,0,0]=4 915 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [0,1,0,0,0,0|3,0,0]=4 916 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.10 COCc1cncc(c1)Cl 34a_100000092867_200000210301 [0,1,0,0,0,0|3,0,0]=4 918 B10R1.10 COCc1cncc(c1)Cl 34a_100138415774_100016992070 [0,1,0,0,0,0|3,0,0]=4 919 B10R1.10 COCc1cncc(c1)Cl 7a_100000092867_200000210301 [0,1,0,0,0,0|3,0,0]=4 920 B10R1.10 COCc1cncc(c1)F 34a_100011962875_200000210301 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.10 COCc1cncc(c1)F 34a_100138415774_100000725299 [0,1,0,0,0,0|3,0,0]=4 922 B10R1.10 COCc1cncc(c1)F 7a_100011962875_200000210301 [0,1,0,0,0,0|3,0,0]=4 923 B10R1.10 COCc1cncc(c1)N 34a_100000085308_200000210301 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.10 CSCc1cc(ccn1)Br 62a_100010173614_200000210301 [0,1,0,0,0,0|3,0,0]=4 925 B10R1.10 CSCc1cc(ccn1)Br 62a_200000210301_100010173614 [0,1,0,0,0,0|3,0,0]=4 926 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [0,1,0,0,0,0|3,0,0]=4 927 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [0,1,0,0,0,0|3,0,0]=4 928 B10R1.10 CSCc1cc(ccn1)Cl 62a_100016988179_200000210301 [0,1,0,0,0,0|3,0,0]=4 929 B10R1.10 CSCc1cc(ccn1)Cl 62a_200000210301_100016988179 [0,1,0,0,0,0|3,0,0]=4 930 B10R1.10 CSCc1cccc(n1)Br 62a_100009889011_200000210301 [0,1,0,0,0,0|3,0,0]=4 931 B10R1.10 CSCc1cccc(n1)Br 62a_200000210301_100009889011 [0,1,0,0,0,0|3,0,0]=4 932 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [0,1,0,0,0,0|3,0,0]=4 933 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [0,1,0,0,0,0|3,0,0]=4 934 B10R1.10 CSCc1cccc(n1)Cl 62a_100000086093_200000210301 [0,1,0,0,0,0|3,0,0]=4 935 B10R1.10 CSCc1cccc(n1)Cl 62a_200000210301_100000086093 [0,1,0,0,0,0|3,0,0]=4 936 B10R1.10 CSCc1cccc(n1)F 62a_100009819644_200000210301 [0,1,0,0,0,0|3,0,0]=4 937 B10R1.10 CSCc1cccc(n1)F 62a_200000210301_100009819644 [0,1,0,0,0,0|3,0,0]=4 938 B10R1.10 CSCc1cncc(c1)Br 62a_100000738771_200000210301 [0,1,0,0,0,0|3,0,0]=4 939 B10R1.10 CSCc1cncc(c1)Br 62a_200000210301_100000738771 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [0,1,0,0,0,0|3,0,0]=4 942 B10R1.10 CSCc1cncc(c1)Cl 62a_100016992070_200000210301 [0,1,0,0,0,0|3,0,0]=4 943 B10R1.10 CSCc1cncc(c1)Cl 62a_200000210301_100016992070 [0,1,0,0,0,0|3,0,0]=4 944 B10R1.10 CSCc1cncc(c1)F 62a_100000725299_200000210301 [0,1,0,0,0,0|3,0,0]=4 945 B10R1.10 CSCc1cncc(c1)F 62a_200000210301_100000725299 [0,1,0,0,0,0|3,0,0]=4 946 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [0,1,0,0,0,0|3,0,0]=4 947 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [0,1,0,0,0,0|3,0,0]=4 948 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [0,1,0,0,0,0|3,0,0]=4 949 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [0,1,0,0,0,0|3,0,0]=4 950 B10R1.10 Cc1cccc(n1)SCF 62a_100000742759_100015361967 [0,1,0,0,0,0|3,0,0]=4 951 B10R1.10 Cc1cccc(n1)SCF 62a_100015361967_100000742759 [0,1,0,0,0,0|3,0,0]=4 952 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [0,1,0,0,0,0|3,0,0]=4 953 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [0,1,0,0,0,0|3,0,0]=4 954 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [0,1,0,0,0,0|3,0,0]=4 955 B10R1.10 Cc1ccnc(c1)SCF 62a_100000750283_100015361967 [0,1,0,0,0,0|3,0,0]=4 956 B10R1.10 Cc1ccnc(c1)SCF 62a_100015361967_100000750283 [0,1,0,0,0,0|3,0,0]=4 957 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [0,1,0,0,0,0|3,0,0]=4 958 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [0,1,0,0,0,0|3,0,0]=4 959 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [0,1,0,0,0,0|3,0,0]=4 960 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [0,1,0,0,0,0|3,0,0]=4 961 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [0,1,0,0,0,0|3,0,0]=4 962 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [0,1,0,0,0,0|3,0,0]=4 963 B10R1.10 Cc1cncc(c1)OCF 34a_100011830280_100015361967 [0,1,0,0,0,0|3,0,0]=4 964 B10R1.10 Cc1cncc(c1)OCF 7a_100011830280_100015361967 [0,1,0,0,0,0|3,0,0]=4 965 B10R1.10 Cc1cncc(c1)SCF 62a_100000760492_100015361967 [0,1,0,0,0,0|3,0,0]=4 966 B10R1.10 Cc1cncc(c1)SCF 62a_100015361967_100000760492 [0,1,0,0,0,0|3,0,0]=4 967 B10R1.10 Cc1cncc(n1)SCF 62a_100000754123_100015361967 [0,1,0,0,0,0|2,0,0]=3 968 B10R1.10 Cc1cncc(n1)SCF 62a_100015361967_100000754123 [0,1,0,0,0,0|2,0,0]=3 969 B10R1.10 FCOc1cccc(n1)F 34a_100011432558_100015361967 [0,1,0,0,0,0|3,0,0]=4 970 B10R1.10 FCOc1cncc(c1)Br 34a_100000754920_100015361967 [0,1,0,0,0,0|3,0,0]=4 971 B10R1.10 FCOc1cncc(c1)Br 7a_100000754920_100015361967 [0,1,0,0,0,0|3,0,0]=4 972 B10R1.10 FCOc1cncc(c1)Cl 7a_100000032511_100015361967 [0,1,0,0,0,0|3,0,0]=4 973 B10R1.10 FCOc1cncc(c1)F 34a_100011830296_100015361967 [0,1,0,0,0,0|3,0,0]=4 974 B10R1.10 FCOc1cncc(c1)F 7a_100011830296_100015361967 [0,1,0,0,0,0|3,0,0]=4 975 B10R1.10 FCSc1cc(ccn1)Cl 62a_100010167805_100015361967 [0,1,0,0,0,0|3,0,0]=4 976 B10R1.10 FCSc1cc(ccn1)Cl 62a_100015361967_100010167805 [0,1,0,0,0,0|3,0,0]=4 977 B10R1.10 FCSc1cc(ccn1)F 62a_100000764206_100015361967 [0,1,0,0,0,0|3,0,0]=4 978 B10R1.10 FCSc1cc(ccn1)F 62a_100015361967_100000764206 [0,1,0,0,0,0|3,0,0]=4 979 B10R1.10 FCSc1cccc(n1)Br 62a_100000684672_100015361967 [0,1,0,0,0,0|3,0,0]=4 980 B10R1.10 FCSc1cccc(n1)Br 62a_100015361967_100000684672 [0,1,0,0,0,0|3,0,0]=4 981 B10R1.10 FCSc1cccc(n1)Cl 62a_100000051397_100015361967 [0,1,0,0,0,0|3,0,0]=4 982 B10R1.10 FCSc1cccc(n1)Cl 62a_100015361967_100000051397 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.10 FCSc1cccc(n1)F 62a_100009815982_100015361967 [0,1,0,0,0,0|3,0,0]=4 984 B10R1.10 FCSc1cccc(n1)F 62a_100015361967_100009815982 [0,1,0,0,0,0|3,0,0]=4 985 B10R1.10 FCSc1cncc(c1)Br 62a_100000728054_100015361967 [0,1,0,0,0,0|3,0,0]=4 986 B10R1.10 FCSc1cncc(c1)Br 62a_100015361967_100000728054 [0,1,0,0,0,0|3,0,0]=4 987 B10R1.10 FCSc1cncc(c1)Cl 62a_100000049639_100015361967 [0,1,0,0,0,0|3,0,0]=4 988 B10R1.10 FCSc1cncc(c1)Cl 62a_100015361967_100000049639 [0,1,0,0,0,0|3,0,0]=4 989 B10R1.10 FCSc1cncc(c1)F 62a_100000744099_100015361967 [0,1,0,0,0,0|3,0,0]=4 990 B10R1.10 FCSc1cncc(c1)F 62a_100015361967_100000744099 [0,1,0,0,0,0|3,0,0]=4 991 B10R1.10 FCSc1cncc(n1)Cl 62a_100010892449_100015361967 [0,1,0,0,0,0|2,0,0]=3 992 B10R1.10 FCSc1cncc(n1)Cl 62a_100015361967_100010892449 [0,1,0,0,0,0|2,0,0]=3 993 B10R1.10 FCSc1cncc(n1)F 62a_100015361967_200009863489 [0,1,0,0,0,0|2,0,0]=3 994 B10R1.10 FCSc1cncc(n1)F 62a_200009863489_100015361967 [0,1,0,0,0,0|2,0,0]=3 995 B10R1.10 N#CCc1cc(ccn1)O 271570a_203496583355_100009875060 [0,1,0,0,0,0|2,0,1]=4 996 B10R1.10 N#CCc1cccc(n1)O 271570a_203496583355_100000727631 [0,1,0,0,0,0|2,0,1]=4 997 B10R1.10 N#CCc1cncc(c1)O 271570a_203496583355_100015508350 [0,1,0,0,0,0|2,0,1]=4 998 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [0,1,0,0,0,0|3,0,0]=4 999 B10R1.10 Nc1cccc(n1)SCF 62a_100000740741_100015361967 [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.10 Nc1cccc(n1)SCF 62a_100015361967_100000740741 [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.10 Nc1ccnc(c1)SCF 62a_100009814236_100015361967 [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.10 Nc1ccnc(c1)SCF 62a_100015361967_100009814236 [0,1,0,0,0,0|3,0,0]=4 1003 B10R1.10 Nc1cncc(c1)OCF 34a_100011997051_100015361967 [0,1,0,0,0,0|3,0,0]=4 1004 B10R1.10 Nc1cncc(c1)SCF 62a_100000687067_100015361967 [0,1,0,0,0,0|3,0,0]=4 1005 B10R1.10 Nc1cncc(c1)SCF 62a_100015361967_100000687067 [0,1,0,0,0,0|3,0,0]=4 1006 B10R1.10 Nc1cncc(n1)SCF 62a_100000747728_100015361967 [0,1,0,0,0,0|2,0,0]=3 1007 B10R1.10 Nc1cncc(n1)SCF 62a_100015361967_100000747728 [0,1,0,0,0,0|2,0,0]=3 1008 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [0,1,0,0,0,0|2,1,0]=4 1009 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [0,1,0,0,0,0|1,1,0]=3 1010 B10R1.10 Oc1ccnc(c1)SCF 62a_100015361967_100000762945 [0,1,0,0,0,0|3,0,0]=4 1011 B10R1.10 Oc1cncc(c1)SCF 62a_100000754920_100015361967 [0,1,0,0,0,0|3,0,0]=4 1012 B10R1.10 Oc1cncc(c1)SCF 62a_100015361967_100000754920 [0,1,0,0,0,0|3,0,0]=4 1013 B10R1.10 Oc1cncc(n1)SCF 62a_100015361967_100011269956 [0,1,0,0,0,0|2,0,0]=3 1014 B10R1.10 [13CH3]NCc1cccc(n1)Br 2230a_100016987751_200025704644 [0,1,0,0,0,0|3,0,0]=4 1015 B10R1.10 [13CH3]NCc1cccc(n1)Cl 2230a_100016990191_200025704644 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.10 [13CH3]NCc1cccc(n1)F 2230a_100015188798_200025704644 [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.10 [13CH3]NCc1cccc(n1)F 34a_100015188798_200025704644 [0,1,0,0,0,0|3,0,0]=4 1018 B10R1.10 [13CH3]NCc1cncc(c1)Cl 2230a_200020614424_200025704644 [0,1,0,0,0,0|3,0,0]=4 1019 B10R1.10 [13CH3]NCc1cncc(c1)F 2230a_100011962886_200025704644 [0,1,0,0,0,0|3,0,0]=4 1020 B10R1.10 [13CH3]NCc1cncc(c1)F 34a_100011962886_200025704644 [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.10 [13CH3]OCc1cc(ccn1)Cl 34a_100000748867_200025704644 [0,1,0,0,0,0|3,0,0]=4 1022 B10R1.10 [13CH3]OCc1cc(ccn1)N 34a_100000692640_200025704644 [0,1,0,0,0,0|3,0,0]=4 1023 B10R1.10 [13CH3]OCc1cccc(n1)Br 34a_100000694195_200025704644 [0,1,0,0,0,0|3,0,0]=4 1024 B10R1.10 [13CH3]OCc1cccc(n1)Cl 34a_100011998359_200025704644 [0,1,0,0,0,0|3,0,0]=4 1025 B10R1.10 [13CH3]OCc1cccc(n1)F 34a_100000086748_200025704644 [0,1,0,0,0,0|3,0,0]=4 1026 B10R1.10 [13CH3]OCc1cncc(c1)Br 34a_100011259137_200025704644 [0,1,0,0,0,0|3,0,0]=4 1027 B10R1.10 [13CH3]OCc1cncc(c1)Br 7a_100011259137_200025704644 [0,1,0,0,0,0|3,0,0]=4 1028 B10R1.10 [13CH3]OCc1cncc(c1)Cl 34a_100000092867_200025704644 [0,1,0,0,0,0|3,0,0]=4 1029 B10R1.10 [13CH3]OCc1cncc(c1)Cl 7a_100000092867_200025704644 [0,1,0,0,0,0|3,0,0]=4 1030 B10R1.10 [13CH3]OCc1cncc(c1)F 34a_100011962875_200025704644 [0,1,0,0,0,0|3,0,0]=4 1031 B10R1.10 [13CH3]OCc1cncc(c1)F 7a_100011962875_200025704644 [0,1,0,0,0,0|3,0,0]=4 1032 B10R1.10 [13CH3]OCc1cncc(c1)N 34a_100000085308_200025704644 [0,1,0,0,0,0|3,0,0]=4 1033 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_100010173614_200025704644 [0,1,0,0,0,0|3,0,0]=4 1034 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_200025704644_100010173614 [0,1,0,0,0,0|3,0,0]=4 1035 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_100016988179_200025704644 [0,1,0,0,0,0|3,0,0]=4 1036 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_200025704644_100016988179 [0,1,0,0,0,0|3,0,0]=4 1037 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_100009889011_200025704644 [0,1,0,0,0,0|3,0,0]=4 1038 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_200025704644_100009889011 [0,1,0,0,0,0|3,0,0]=4 1039 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_100000086093_200025704644 [0,1,0,0,0,0|3,0,0]=4 1040 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_200025704644_100000086093 [0,1,0,0,0,0|3,0,0]=4 1041 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_100009819644_200025704644 [0,1,0,0,0,0|3,0,0]=4 1042 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_200025704644_100009819644 [0,1,0,0,0,0|3,0,0]=4 1043 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_100000738771_200025704644 [0,1,0,0,0,0|3,0,0]=4 1044 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_200025704644_100000738771 [0,1,0,0,0,0|3,0,0]=4 1045 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_100016992070_200025704644 [0,1,0,0,0,0|3,0,0]=4 1046 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_200025704644_100016992070 [0,1,0,0,0,0|3,0,0]=4 1047 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_100000725299_200025704644 [0,1,0,0,0,0|3,0,0]=4 1048 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_200025704644_100000725299 [0,1,0,0,0,0|3,0,0]=4 1049 B10R1.10 [O-][n+]1ccnc(c1)SCF 62a_100015361967_100009880115 [0,1,0,0,0,0|2,0,1]=4 1050 B10R1.15 CC(N[13CH3])c1ccccn1 2230a_100000181244_200025704644 [0,1,0,0,0,0|3,0,0]=4 1051 B10R1.15 CC(N[13CH3])c1cccnc1 2230a_100000195435_200025704644 [0,1,0,0,0,0|3,0,0]=4 1052 B10R1.15 CC(S[13CH3])c1cnccn1 62a_200000703233_200025704644 [0,1,0,0,0,0|2,0,0]=3 1053 B10R1.15 CC(S[13CH3])c1cnccn1 62a_200025704644_200000703233 [0,1,0,0,0,0|2,0,0]=3 1054 B10R1.15 CNC(C)c1ccccn1 2230a_100000181244_200000210301 [0,1,0,0,0,0|3,0,0]=4 1055 B10R1.15 CNC(C)c1ccccn1 269862a_106832991636_100000210467 [0,1,0,0,0,0|3,0,0]=4 1056 B10R1.15 CNC(C)c1cccnc1 2230a_100000195435_200000210301 [0,1,0,0,0,0|3,0,0]=4 1057 B10R1.15 CNC(C)c1cccnc1 269862a_106832991636_100000210468 [0,1,0,0,0,0|3,0,0]=4 1058 B10R1.15 CNC(C)c1cnccn1 2230a_106832991635_200000703233 [0,1,0,0,0,0|2,0,0]=3 1059 B10R1.15 CNC(C)c1cnccn1 269862a_106832991636_100000751083 [0,1,0,0,0,0|2,0,0]=3 1060 B10R1.15 CNC(C)c1cnccn1 7a_106832991635_200000703233 [0,1,0,0,0,0|2,0,0]=3 1061 B10R1.15 CN[C@H](C)c1cnccn1 2230a_100020589798_200000210301 [0,1,0,0,0,0|2,0,0]=3 1062 B10R1.15 CSC(C)c1cnccn1 62a_200000210301_200000703233 [0,1,0,0,0,0|2,0,0]=3 1063 B10R1.15 CSC(C)c1cnccn1 62a_200000703233_200000210301 [0,1,0,0,0,0|2,0,0]=3 1064 B10R1.15 C[C@@H](N[13CH3])c1cnccn1 2230a_100020589798_200025704644 [0,1,0,0,0,0|2,0,0]=3 1065 B10R1.17 C#CCNc1cnccn1 27a_100000212058_100000211759 [0,1,0,0,0,0|1,0,1]=3 1066 B10R1.17 C#CCOc1cccnc1 34a_100000210849_100000184674 [0,1,0,0,0,0|2,0,1]=4 1067 B10R1.17 C#CCOc1cccnc1 7a_100000210849_100000038162 [0,1,0,0,0,0|2,0,1]=4 1068 B10R1.17 C#CCSc1ccccn1 62a_100000038162_100011216584 [0,1,0,0,0,0|2,0,1]=4 1069 B10R1.17 C#CCSc1cccnc1 62a_100000038162_100000210063 [0,1,0,0,0,0|2,0,1]=4 1070 B10R1.17 C#CCSc1cnccn1 62a_100000038162_100000211759 [0,1,0,0,0,0|1,0,1]=3 1071 B10R1.17 C=CCNc1cnccn1 27a_100020586998_100000211759 [0,1,0,0,0,0|1,0,1]=3 1072 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [0,1,0,0,0,0|2,0,1]=4 1073 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [0,1,0,0,0,0|2,0,1]=4 1074 B10R1.17 C=CCSc1ccccn1 62a_100000210623_100011216584 [0,1,0,0,0,0|2,0,1]=4 1075 B10R1.17 C=CCSc1ccccn1 62a_100011216584_100000210623 [0,1,0,0,0,0|2,0,1]=4 1076 B10R1.17 C=CCSc1cccnc1 62a_100000210063_100000210623 [0,1,0,0,0,0|2,0,1]=4 1077 B10R1.17 C=CCSc1cccnc1 62a_100000210623_100000210063 [0,1,0,0,0,0|2,0,1]=4 1078 B10R1.17 C=CCSc1cnccn1 62a_100000210623_100000211759 [0,1,0,0,0,0|1,0,1]=3 1079 B10R1.17 C=CCSc1cnccn1 62a_100000211759_100000210623 [0,1,0,0,0,0|1,0,1]=3 1080 B10R1.17 CC=NNc1cnccn1 4a_100000736894_200000210099 [0,1,0,0,0,0|2,0,1]=4 1081 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [0,1,0,0,0,0|3,0,0]=4 1082 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [0,1,0,0,0,0|2,0,0]=3 1083 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [0,1,0,0,0,0|2,0,0]=3 1084 B10R1.17 CCCCc1cccnn1 271570a_100020621405_100016991348 [0,1,0,0,0,0|3,0,0]=4 1085 B10R1.17 CCCCc1ccncn1 271570a_100020621405_100000703185 [0,1,0,0,0,0|3,0,0]=4 1086 B10R1.17 CCCCc1ccnnc1 271570a_100020621405_100000732662 [0,1,0,0,0,0|3,0,0]=4 1087 B10R1.17 CCCCc1cnccn1 271570a_100020621405_100000758340 [0,1,0,0,0,0|1,0,0]=2 1088 B10R1.17 CCCCc1cncnc1 271570a_100020621405_100011206942 [0,1,0,0,0,0|3,0,0]=4 1089 B10R1.17 CCCCc1ncccn1 271570a_100020621405_100000211032 [0,1,0,0,0,0|3,0,0]=4 1090 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [0,1,0,0,0,0|3,0,0]=4 1091 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [0,1,0,0,0,0|3,0,0]=4 1092 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [0,1,0,0,0,0|3,0,0]=4 1093 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [0,1,0,0,0,0|2,0,0]=3 1094 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [0,1,0,0,0,0|2,0,0]=3 1095 B10R1.17 CCCOc1ccnnc1 34a_100015204005_100000210303 [0,1,0,0,0,0|3,0,0]=4 1096 B10R1.17 CCCOc1cncnc1 7a_100000754086_100000210303 [0,1,0,0,0,0|3,0,0]=4 1097 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [0,1,0,0,0,0|3,0,0]=4 1098 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [0,1,0,0,0,0|3,0,0]=4 1099 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [0,1,0,0,0,0|2,0,0]=3 1100 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [0,1,0,0,0,0|2,0,0]=3 1101 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [0,1,0,0,0,0|2,0,0]=3 1102 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [0,1,0,0,0,0|2,0,0]=3 1103 B10R1.17 CCCSc1cccnn1 62a_100000210303_100016991348 [0,1,0,0,0,0|3,0,0]=4 1104 B10R1.17 CCCSc1cccnn1 62a_100016991348_100000210303 [0,1,0,0,0,0|3,0,0]=4 1105 B10R1.17 CCCSc1ccncn1 62a_100000210303_100000703185 [0,1,0,0,0,0|3,0,0]=4 1106 B10R1.17 CCCSc1ccncn1 62a_100000703185_100000210303 [0,1,0,0,0,0|3,0,0]=4 1107 B10R1.17 CCCSc1ccnnc1 62a_100000210303_100000732662 [0,1,0,0,0,0|3,0,0]=4 1108 B10R1.17 CCCSc1ccnnc1 62a_100000732662_100000210303 [0,1,0,0,0,0|3,0,0]=4 1109 B10R1.17 CCCSc1cnccn1 62a_100000210303_100000211759 [0,1,0,0,0,0|1,0,0]=2 1110 B10R1.17 CCCSc1cnccn1 62a_100000211759_100000210303 [0,1,0,0,0,0|1,0,0]=2 1111 B10R1.17 CCCSc1cncnc1 62a_100000210303_100011206942 [0,1,0,0,0,0|3,0,0]=4 1112 B10R1.17 CCCSc1cncnc1 62a_100011206942_100000210303 [0,1,0,0,0,0|3,0,0]=4 1113 B10R1.17 CCCSc1ncccn1 62a_100000210303_100000211032 [0,1,0,0,0,0|3,0,0]=4 1114 B10R1.17 CCCSc1ncccn1 62a_100000211032_100000210303 [0,1,0,0,0,0|3,0,0]=4 1115 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [0,1,0,0,0,0|3,0,0]=4 1116 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [0,1,0,0,0,0|3,0,0]=4 1117 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [0,1,0,0,0,0|3,0,0]=4 1118 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [0,1,0,0,0,0|3,0,0]=4 1119 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [0,1,0,0,0,0|3,0,0]=4 1120 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [0,1,0,0,0,0|2,0,0]=3 1121 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [0,1,0,0,0,0|2,0,0]=3 1122 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [0,1,0,0,0,0|2,0,0]=3 1123 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [0,1,0,0,0,0|2,0,0]=3 1124 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [0,1,0,0,0,0|2,0,0]=3 1125 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [0,1,0,0,0,0|2,0,0]=3 1126 B10R1.17 CCNCc1cccnn1 2230a_100015525214_100016990269 [0,1,0,0,0,0|3,0,0]=4 1127 B10R1.17 CCNCc1cccnn1 2230a_100159270163_100000210202 [0,1,0,0,0,0|3,0,0]=4 1128 B10R1.17 CCNCc1ccnnc1 270004a_100015525214_100011934578 [0,1,0,0,0,0|3,0,0]=4 1129 B10R1.17 CCNCc1cnccn1 2230a_100015525214_100016995436 [0,1,0,0,0,0|1,0,0]=2 1130 B10R1.17 CCNCc1cnccn1 270004a_100015525214_100000749867 [0,1,0,0,0,0|1,0,0]=2 1131 B10R1.17 CCNCc1cncnc1 2230a_100011243677_100000210202 [0,1,0,0,0,0|3,0,0]=4 1132 B10R1.17 CCNCc1cncnc1 2230a_100015525214_100015196519 [0,1,0,0,0,0|3,0,0]=4 1133 B10R1.17 CCNCc1cncnc1 270004a_100015525214_100000749868 [0,1,0,0,0,0|3,0,0]=4 1134 B10R1.17 CCNCc1ncccn1 2230a_100015525214_100000703007 [0,1,0,0,0,0|3,0,0]=4 1135 B10R1.17 CCNCc1ncccn1 270004a_100015525214_100011532527 [0,1,0,0,0,0|3,0,0]=4 1136 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [0,1,0,0,0,0|3,0,0]=4 1137 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [0,1,0,0,0,0|3,0,0]=4 1138 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [0,1,0,0,0,0|3,0,0]=4 1139 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [0,1,0,0,0,0|2,0,0]=3 1140 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [0,1,0,0,0,0|2,0,0]=3 1141 B10R1.17 CCOCc1cccnn1 34a_100121572206_100016990269 [0,1,0,0,0,0|3,0,0]=4 1142 B10R1.17 CCOCc1cnccn1 34a_100121572206_100016995436 [0,1,0,0,0,0|1,0,0]=2 1143 B10R1.17 CCOCc1cncnc1 34a_100121572206_100015196519 [0,1,0,0,0,0|3,0,0]=4 1144 B10R1.17 CCOCc1ncccn1 34a_100121572206_100000703007 [0,1,0,0,0,0|3,0,0]=4 1145 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [0,1,0,0,0,0|3,0,0]=4 1146 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [0,1,0,0,0,0|3,0,0]=4 1147 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [0,1,0,0,0,0|2,0,0]=3 1148 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [0,1,0,0,0,0|2,0,0]=3 1149 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [0,1,0,0,0,0|2,0,0]=3 1150 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [0,1,0,0,0,0|2,0,0]=3 1151 B10R1.17 CCSCc1cccnn1 62a_100000210202_100016990269 [0,1,0,0,0,0|3,0,0]=4 1152 B10R1.17 CCSCc1cccnn1 62a_100016990269_100000210202 [0,1,0,0,0,0|3,0,0]=4 1153 B10R1.17 CCSCc1cnccn1 62a_100000210202_100016995436 [0,1,0,0,0,0|1,0,0]=2 1154 B10R1.17 CCSCc1cnccn1 62a_100016995436_100000210202 [0,1,0,0,0,0|1,0,0]=2 1155 B10R1.17 CCSCc1cncnc1 62a_100000210202_100015196519 [0,1,0,0,0,0|3,0,0]=4 1156 B10R1.17 CCSCc1cncnc1 62a_100015196519_100000210202 [0,1,0,0,0,0|3,0,0]=4 1157 B10R1.17 CCSCc1ncccn1 62a_100000210202_100000703007 [0,1,0,0,0,0|3,0,0]=4 1158 B10R1.17 CCSCc1ncccn1 62a_100000703007_100000210202 [0,1,0,0,0,0|3,0,0]=4 1159 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [0,1,0,0,0,0|3,0,0]=4 1160 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [0,1,0,0,0,0|3,0,0]=4 1161 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [0,1,0,0,0,0|3,0,0]=4 1162 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [0,1,0,0,0,0|3,0,0]=4 1163 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [0,1,0,0,0,0|3,0,0]=4 1164 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [0,1,0,0,0,0|2,0,0]=3 1165 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [0,1,0,0,0,0|2,0,0]=3 1166 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [0,1,0,0,0,0|2,0,0]=3 1167 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [0,1,0,0,0,0|2,0,0]=3 1168 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [0,1,0,0,0,0|2,0,0]=3 1169 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [0,1,0,0,0,0|2,1,0]=4 1170 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [0,1,0,0,0,0|2,1,0]=4 1171 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [0,1,0,0,0,0|2,1,0]=4 1172 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [0,1,0,0,0,0|1,1,0]=3 1173 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [0,1,0,0,0,0|1,1,0]=3 1174 B10R1.17 COCCc1cnccn1 34a_100011349526_200000210301 [0,1,0,0,0,0|0,1,0]=2 1175 B10R1.17 COCCc1cncnc1 34a_100011709255_200000210301 [0,1,0,0,0,0|2,1,0]=4 1176 B10R1.17 COCSc1ccccn1 62a_100000766300_100011216584 [0,1,0,0,0,0|2,1,0]=4 1177 B10R1.17 COCSc1ccccn1 62a_100011216584_100000766300 [0,1,0,0,0,0|2,1,0]=4 1178 B10R1.17 COCSc1cccnc1 62a_100000210063_100000766300 [0,1,0,0,0,0|2,1,0]=4 1179 B10R1.17 COCSc1cccnc1 62a_100000766300_100000210063 [0,1,0,0,0,0|2,1,0]=4 1180 B10R1.17 COCSc1cnccn1 62a_100000211759_100000766300 [0,1,0,0,0,0|1,1,0]=3 1181 B10R1.17 COCSc1cnccn1 62a_100000766300_100000211759 [0,1,0,0,0,0|1,1,0]=3 1182 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [0,1,0,0,0,0|2,0,0]=3 1183 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [0,1,0,0,0,0|2,0,0]=3 1184 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [0,1,0,0,0,0|1,0,0]=2 1185 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [0,1,0,0,0,0|1,0,0]=2 1186 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [0,1,0,0,0,0|1,0,0]=2 1187 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [0,1,0,0,0,0|1,0,0]=2 1188 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [0,1,0,0,0,0|3,0,0]=4 1189 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [0,1,0,0,0,0|3,0,0]=4 1190 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [0,1,0,0,0,0|3,0,0]=4 1191 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [0,1,0,0,0,0|3,0,0]=4 1192 B10R1.17 CSCOc1cccnc1 34a_100000210849_100011218213 [0,1,0,0,0,0|2,0,0]=3 1193 B10R1.17 CSCOc1ccnnc1 34a_100015204005_100011218213 [0,1,0,0,0,0|3,0,0]=4 1194 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [0,1,0,0,0,0|3,0,0]=4 1195 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [0,1,0,0,0,0|3,0,0]=4 1196 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [0,1,0,0,0,0|3,0,0]=4 1197 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [0,1,0,0,0,0|3,0,0]=4 1198 B10R1.17 CSCSc1ccccn1 62a_100011216584_100011218213 [0,1,0,0,0,0|2,0,0]=3 1199 B10R1.17 CSCSc1ccccn1 62a_100011218213_100011216584 [0,1,0,0,0,0|2,0,0]=3 1200 B10R1.17 CSCSc1cccnc1 62a_100000210063_100011218213 [0,1,0,0,0,0|2,0,0]=3 1201 B10R1.17 CSCSc1cccnc1 62a_100011218213_100000210063 [0,1,0,0,0,0|2,0,0]=3 1202 B10R1.17 CSCSc1cccnn1 62a_100011218213_100016991348 [0,1,0,0,0,0|3,0,0]=4 1203 B10R1.17 CSCSc1cccnn1 62a_100016991348_100011218213 [0,1,0,0,0,0|3,0,0]=4 1204 B10R1.17 CSCSc1ccncn1 62a_100000703185_100011218213 [0,1,0,0,0,0|3,0,0]=4 1205 B10R1.17 CSCSc1ccncn1 62a_100011218213_100000703185 [0,1,0,0,0,0|3,0,0]=4 1206 B10R1.17 CSCSc1ccnnc1 62a_100000732662_100011218213 [0,1,0,0,0,0|3,0,0]=4 1207 B10R1.17 CSCSc1ccnnc1 62a_100011218213_100000732662 [0,1,0,0,0,0|3,0,0]=4 1208 B10R1.17 CSCSc1cnccn1 62a_100000211759_100011218213 [0,1,0,0,0,0|1,0,0]=2 1209 B10R1.17 CSCSc1cnccn1 62a_100011218213_100000211759 [0,1,0,0,0,0|1,0,0]=2 1210 B10R1.17 CSCSc1cncnc1 62a_100011206942_100011218213 [0,1,0,0,0,0|3,0,0]=4 1211 B10R1.17 CSCSc1cncnc1 62a_100011218213_100011206942 [0,1,0,0,0,0|3,0,0]=4 1212 B10R1.17 CSCSc1ncccn1 62a_100000211032_100011218213 [0,1,0,0,0,0|3,0,0]=4 1213 B10R1.17 CSCSc1ncccn1 62a_100011218213_100000211032 [0,1,0,0,0,0|3,0,0]=4 1214 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [0,1,0,0,0,0|3,0,0]=4 1215 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [0,1,0,0,0,0|3,0,0]=4 1216 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [0,1,0,0,0,0|3,0,0]=4 1217 B10R1.17 FCCOc1cccnc1 34a_100000210849_100011217306 [0,1,0,0,0,0|2,0,0]=3 1218 B10R1.17 FCCOc1cccnc1 7a_100000210849_100011217306 [0,1,0,0,0,0|2,0,0]=3 1219 B10R1.17 FCCOc1ccnnc1 34a_100015204005_100011217306 [0,1,0,0,0,0|3,0,0]=4 1220 B10R1.17 FCCOc1cncnc1 7a_100000754086_100011217306 [0,1,0,0,0,0|3,0,0]=4 1221 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [0,1,0,0,0,0|3,0,0]=4 1222 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [0,1,0,0,0,0|3,0,0]=4 1223 B10R1.17 FCCSc1ccccn1 62a_100011216584_100011217306 [0,1,0,0,0,0|2,0,0]=3 1224 B10R1.17 FCCSc1ccccn1 62a_100011217306_100011216584 [0,1,0,0,0,0|2,0,0]=3 1225 B10R1.17 FCCSc1cccnc1 62a_100000210063_100011217306 [0,1,0,0,0,0|2,0,0]=3 1226 B10R1.17 FCCSc1cccnc1 62a_100011217306_100000210063 [0,1,0,0,0,0|2,0,0]=3 1227 B10R1.17 FCCSc1cccnn1 62a_100011217306_100016991348 [0,1,0,0,0,0|3,0,0]=4 1228 B10R1.17 FCCSc1cccnn1 62a_100016991348_100011217306 [0,1,0,0,0,0|3,0,0]=4 1229 B10R1.17 FCCSc1ccncn1 62a_100000703185_100011217306 [0,1,0,0,0,0|3,0,0]=4 1230 B10R1.17 FCCSc1ccncn1 62a_100011217306_100000703185 [0,1,0,0,0,0|3,0,0]=4 1231 B10R1.17 FCCSc1ccnnc1 62a_100000732662_100011217306 [0,1,0,0,0,0|3,0,0]=4 1232 B10R1.17 FCCSc1ccnnc1 62a_100011217306_100000732662 [0,1,0,0,0,0|3,0,0]=4 1233 B10R1.17 FCCSc1cnccn1 62a_100000211759_100011217306 [0,1,0,0,0,0|1,0,0]=2 1234 B10R1.17 FCCSc1cnccn1 62a_100011217306_100000211759 [0,1,0,0,0,0|1,0,0]=2 1235 B10R1.17 FCCSc1cncnc1 62a_100011206942_100011217306 [0,1,0,0,0,0|3,0,0]=4 1236 B10R1.17 FCCSc1cncnc1 62a_100011217306_100011206942 [0,1,0,0,0,0|3,0,0]=4 1237 B10R1.17 FCCSc1ncccn1 62a_100000211032_100011217306 [0,1,0,0,0,0|3,0,0]=4 1238 B10R1.17 FCCSc1ncccn1 62a_100011217306_100000211032 [0,1,0,0,0,0|3,0,0]=4 1239 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [0,1,0,0,0,0|3,0,0]=4 1240 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [0,1,0,0,0,0|3,0,0]=4 1241 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [0,1,0,0,0,0|3,0,0]=4 1242 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [0,1,0,0,0,0|3,0,0]=4 1243 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [0,1,0,0,0,0|3,0,0]=4 1244 B10R1.17 FCSCc1ccccn1 62a_100000721315_100015361967 [0,1,0,0,0,0|2,0,0]=3 1245 B10R1.17 FCSCc1ccccn1 62a_100015361967_100000721315 [0,1,0,0,0,0|2,0,0]=3 1246 B10R1.17 FCSCc1cccnc1 62a_100000741622_100015361967 [0,1,0,0,0,0|2,0,0]=3 1247 B10R1.17 FCSCc1cccnc1 62a_100015361967_100000741622 [0,1,0,0,0,0|2,0,0]=3 1248 B10R1.17 FCSCc1cccnn1 62a_100015361967_100016990269 [0,1,0,0,0,0|3,0,0]=4 1249 B10R1.17 FCSCc1cccnn1 62a_100016990269_100015361967 [0,1,0,0,0,0|3,0,0]=4 1250 B10R1.17 FCSCc1cnccn1 62a_100015361967_100016995436 [0,1,0,0,0,0|1,0,0]=2 1251 B10R1.17 FCSCc1cnccn1 62a_100016995436_100015361967 [0,1,0,0,0,0|1,0,0]=2 1252 B10R1.17 FCSCc1cncnc1 62a_100015196519_100015361967 [0,1,0,0,0,0|3,0,0]=4 1253 B10R1.17 FCSCc1cncnc1 62a_100015361967_100015196519 [0,1,0,0,0,0|3,0,0]=4 1254 B10R1.17 FCSCc1ncccn1 62a_100000703007_100015361967 [0,1,0,0,0,0|3,0,0]=4 1255 B10R1.17 FCSCc1ncccn1 62a_100015361967_100000703007 [0,1,0,0,0,0|3,0,0]=4 1256 B10R1.17 N#CCOc1cccnc1 7a_100000210849_100011215382 [0,1,0,0,0,0|2,0,1]=4 1257 B10R1.17 N#CCSc1ccccn1 62a_100011215382_100011216584 [0,1,0,0,0,0|2,0,1]=4 1258 B10R1.17 N#CCSc1ccccn1 62a_100011216584_100011215382 [0,1,0,0,0,0|2,0,1]=4 1259 B10R1.17 N#CCSc1cccnc1 62a_100000210063_100011215382 [0,1,0,0,0,0|2,0,1]=4 1260 B10R1.17 N#CCSc1cccnc1 62a_100011215382_100000210063 [0,1,0,0,0,0|2,0,1]=4 1261 B10R1.17 N#CCSc1cnccn1 62a_100000211759_100011215382 [0,1,0,0,0,0|1,0,1]=3 1262 B10R1.17 N#CCSc1cnccn1 62a_100011215382_100000211759 [0,1,0,0,0,0|1,0,1]=3 1263 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [0,1,0,0,0,0|1,1,1]=4 1264 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [0,1,0,0,0,0|1,1,1]=4 1265 B10R1.17 O=CCSc1ccccn1 62a_100011216584_200015260668 [0,1,0,0,0,0|1,1,1]=4 1266 B10R1.17 O=CCSc1ccccn1 62a_200015260668_100011216584 [0,1,0,0,0,0|1,1,1]=4 1267 B10R1.17 O=CCSc1cccnc1 62a_100000210063_200015260668 [0,1,0,0,0,0|1,1,1]=4 1268 B10R1.17 O=CCSc1cccnc1 62a_200015260668_100000210063 [0,1,0,0,0,0|1,1,1]=4 1269 B10R1.17 O=CCSc1cnccn1 62a_100000211759_200015260668 [0,1,0,0,0,0|0,1,1]=3 1270 B10R1.17 O=CCSc1cnccn1 62a_200015260668_100000211759 [0,1,0,0,0,0|0,1,1]=3 1271 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [0,1,0,0,0,0|2,1,0]=4 1272 B10R1.17 OCCNc1cccnn1 27a_100000210304_100016991348 [0,1,0,0,0,0|2,1,0]=4 1273 B10R1.17 OCCNc1ccncn1 27a_100000210304_100000703185 [0,1,0,0,0,0|2,1,0]=4 1274 B10R1.17 OCCNc1cnccn1 27a_100000210304_100000211759 [0,1,0,0,0,0|0,1,0]=2 1275 B10R1.17 OCCNc1ncccn1 27a_100000210304_100000211032 [0,1,0,0,0,0|2,1,0]=4 1276 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [0,1,0,0,0,0|2,1,0]=4 1277 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [0,1,0,0,0,0|2,1,0]=4 1278 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [0,1,0,0,0,0|1,1,0]=3 1279 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [0,1,0,0,0,0|1,1,0]=3 1280 B10R1.17 OCCOc1ccnnc1 34a_100015204005_100000211926 [0,1,0,0,0,0|2,1,0]=4 1281 B10R1.17 OCCOc1cncnc1 7a_100000754086_100000211926 [0,1,0,0,0,0|2,1,0]=4 1282 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [0,1,0,0,0,0|2,1,0]=4 1283 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [0,1,0,0,0,0|2,1,0]=4 1284 B10R1.17 OCCSc1ccccn1 62a_100000211926_100011216584 [0,1,0,0,0,0|1,1,0]=3 1285 B10R1.17 OCCSc1ccccn1 62a_100011216584_100000211926 [0,1,0,0,0,0|1,1,0]=3 1286 B10R1.17 OCCSc1cccnc1 62a_100000210063_100000211926 [0,1,0,0,0,0|1,1,0]=3 1287 B10R1.17 OCCSc1cccnc1 62a_100000211926_100000210063 [0,1,0,0,0,0|1,1,0]=3 1288 B10R1.17 OCCSc1cccnn1 62a_100000211926_100016991348 [0,1,0,0,0,0|2,1,0]=4 1289 B10R1.17 OCCSc1cccnn1 62a_100016991348_100000211926 [0,1,0,0,0,0|2,1,0]=4 1290 B10R1.17 OCCSc1ccncn1 62a_100000211926_100000703185 [0,1,0,0,0,0|2,1,0]=4 1291 B10R1.17 OCCSc1ccncn1 62a_100000703185_100000211926 [0,1,0,0,0,0|2,1,0]=4 1292 B10R1.17 OCCSc1ccnnc1 62a_100000211926_100000732662 [0,1,0,0,0,0|2,1,0]=4 1293 B10R1.17 OCCSc1ccnnc1 62a_100000732662_100000211926 [0,1,0,0,0,0|2,1,0]=4 1294 B10R1.17 OCCSc1cnccn1 62a_100000211759_100000211926 [0,1,0,0,0,0|0,1,0]=2 1295 B10R1.17 OCCSc1cnccn1 62a_100000211926_100000211759 [0,1,0,0,0,0|0,1,0]=2 1296 B10R1.17 OCCSc1cncnc1 62a_100000211926_100011206942 [0,1,0,0,0,0|2,1,0]=4 1297 B10R1.17 OCCSc1cncnc1 62a_100011206942_100000211926 [0,1,0,0,0,0|2,1,0]=4 1298 B10R1.17 OCCSc1ncccn1 62a_100000211032_100000211926 [0,1,0,0,0,0|2,1,0]=4 1299 B10R1.17 OCCSc1ncccn1 62a_100000211926_100000211032 [0,1,0,0,0,0|2,1,0]=4 1300 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [0,1,0,0,0,0|3,0,0]=4 1301 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [0,1,0,0,0,0|3,0,0]=4 1302 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [0,1,0,0,0,0|2,0,0]=3 1303 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [0,1,0,0,0,0|2,1,0]=4 1304 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [0,1,0,0,0,0|2,1,0]=4 1305 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [0,1,0,0,0,0|1,1,0]=3 1306 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [0,1,0,0,0,0|1,1,0]=3 1307 B10R1.17 [13CH3]OCCc1cnccn1 34a_100011349526_200025704644 [0,1,0,0,0,0|0,1,0]=2 1308 B10R1.17 [13CH3]OCCc1cncnc1 34a_100011709255_200025704644 [0,1,0,0,0,0|2,1,0]=4 1309 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [0,1,0,0,0,0|2,0,0]=3 1310 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [0,1,0,0,0,0|2,0,0]=3 1311 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [0,1,0,0,0,0|1,0,0]=2 1312 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [0,1,0,0,0,0|1,0,0]=2 1313 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [0,1,0,0,0,0|1,0,0]=2 1314 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [0,1,0,0,0,0|1,0,0]=2 1315 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [0,1,0,0,0,0|3,0,0]=4 1316 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [0,1,0,0,0,0|3,0,0]=4 1317 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [0,1,0,0,0,0|3,0,0]=4 1318 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [0,1,0,0,0,0|3,0,0]=4 1319 B10R1.18 CC(=Cc1cnccn1)C 271570a_100102525489_100000758340 [0,1,0,0,0,0|1,0,2]=4 1320 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [0,1,0,0,0,0|1,1,1]=4 1321 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [0,1,0,0,0,0|1,1,1]=4 1322 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [0,1,0,0,0,0|1,1,1]=4 1323 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [0,1,0,0,0,0|1,1,1]=4 1324 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [0,1,0,0,0,0|0,1,1]=3 1325 B10R1.18 CC(C)Nc1cnccn1 27a_100138425928_100000211759 [0,1,0,0,0,0|2,0,0]=3 1326 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [0,1,0,0,0,0|3,0,0]=4 1327 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [0,1,0,0,0,0|3,0,0]=4 1328 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [0,1,0,0,0,0|3,0,0]=4 1329 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [0,1,0,0,0,0|3,0,0]=4 1330 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [0,1,0,0,0,0|3,0,0]=4 1331 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [0,1,0,0,0,0|3,0,0]=4 1332 B10R1.18 CC(C)Sc1cnccn1 62a_100000210206_100000211759 [0,1,0,0,0,0|2,0,0]=3 1333 B10R1.18 CC(C)Sc1cnccn1 62a_100000211759_100000210206 [0,1,0,0,0,0|2,0,0]=3 1334 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [0,1,0,0,0,0|3,0,0]=4 1335 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [0,1,0,0,0,0|3,0,0]=4 1336 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [0,1,0,0,0,0|3,0,0]=4 1337 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [0,1,0,0,0,0|3,0,0]=4 1338 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [0,1,0,0,0,0|3,0,0]=4 1339 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [0,1,0,0,0,0|3,0,0]=4 1340 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [0,1,0,0,0,0|3,0,0]=4 1341 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [0,1,0,0,0,0|3,0,0]=4 1342 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [0,1,0,0,0,0|3,0,0]=4 1343 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [0,1,0,0,0,0|3,0,0]=4 1344 B10R1.18 CN(C)Cc1cnccn1 2230a_100011269079_200000210301 [0,1,0,0,0,0|2,0,0]=3 1345 B10R1.18 CN(C)Cc1cnccn1 2230a_100102631434_100016995436 [0,1,0,0,0,0|2,0,0]=3 1346 B10R1.18 CN(C)Cc1cnccn1 269982a_100011269079_200000210301 [0,1,0,0,0,0|2,0,0]=3 1347 B10R1.18 CN(C)Cc1cnccn1 269982a_100102631434_100016995436 [0,1,0,0,0,0|2,0,0]=3 1348 B10R1.18 CN(C)Cc1cnccn1 270004a_100102631434_100000749867 [0,1,0,0,0,0|2,0,0]=3 1349 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [0,1,0,0,0,0|3,0,0]=4 1350 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [0,1,0,0,0,0|3,0,0]=4 1351 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [0,1,0,0,0,0|3,0,0]=4 1352 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [0,1,0,0,0,0|3,0,0]=4 1353 B10R1.18 CN([13CH3])Cc1cnccn1 2230a_100011269079_200025704644 [0,1,0,0,0,0|2,0,0]=3 1354 B10R1.18 CN([13CH3])Cc1cnccn1 269982a_100011269079_200025704644 [0,1,0,0,0,0|2,0,0]=3 1355 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [0,1,0,0,0,0|1,1,1]=4 1356 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [0,1,0,0,0,0|1,1,1]=4 1357 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [0,0,1,0,0,0|3,0,0]=4 1358 B8R0.1 C=CC=CC(=O)CCF 1458a_100016291481_100011217306 [0,0,1,0,0,0|3,0,0]=4 1359 B8R0.1 C=CC=CC(=O)CCO 1458a_100016291481_100000211926 [0,0,1,0,0,0|2,1,0]=4 1360 B10R2.6 c1cc(cnn1)C2CC2 271570a_100011220607_100000732662 [0,0,0,1,0,0|3,0,0]=4 1361 B10R2.6 c1cc(ncn1)C2CC2 271570a_100011220607_100000703185 [0,0,0,1,0,0|3,0,0]=4 1362 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [0,0,0,1,0,0|3,0,0]=4 1363 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [0,0,0,1,0,0|2,0,0]=3 1364 B10R2.6 c1cnc(cn1)C2CC2 271570a_100011220607_100000758340 [0,0,0,1,0,0|1,0,0]=2 1365 B10R2.6 c1cnc(nc1)C2CC2 271570a_100011220607_100000211032 [0,0,0,1,0,0|3,0,0]=4 1366 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [0,0,0,1,0,0|2,0,0]=3 1367 B10R2.6 c1cnnc(c1)C2CC2 271570a_100011220607_100016991348 [0,0,0,1,0,0|3,0,0]=4 1368 B10R2.6 c1ncc(cn1)C2CC2 271570a_100011220607_100011206942 [0,0,0,1,0,0|3,0,0]=4 1369 B8R1.8 CCNc1ncns1 27a_100015525214_100000693119 [0,0,0,0,1,0|3,0,0]=4 1370 B8R1.8 CCOc1ccsc1 34a_100000106738_100000210202 [0,0,0,0,1,0|3,0,0]=4 1371 B8R1.8 CCOc1ccsc1 7a_100000106738_100000210202 [0,0,0,0,1,0|3,0,0]=4 1372 B8R1.8 CCSc1c[nH]cn1 62a_100000210202_100000756875 [0,0,0,0,1,0|2,0,1]=4 1373 B8R1.8 CCSc1c[nH]cn1 62a_100000756875_100000210202 [0,0,0,0,1,0|2,0,1]=4 1374 B8R1.8 CCSc1cc[nH]n1 62a_100000062575_100000210202 [0,0,0,0,1,0|3,0,0]=4 1375 B8R1.8 CCSc1cc[nH]n1 62a_100000210202_100000062575 [0,0,0,0,1,0|3,0,0]=4 1376 B8R1.8 CCSc1ccco1 62a_100000210202_100009814098 [0,0,0,0,1,0|3,0,0]=4 1377 B8R1.8 CCSc1ccco1 62a_100009814098_100000210202 [0,0,0,0,1,0|3,0,0]=4 1378 B8R1.8 CCSc1cccs1 62a_100000210202_100011215356 [0,0,0,0,1,0|3,0,0]=4 1379 B8R1.8 CCSc1cccs1 62a_100011215356_100000210202 [0,0,0,0,1,0|3,0,0]=4 1380 B8R1.8 CCSc1ccoc1 62a_100000210202_100011215275 [0,0,0,0,1,0|3,0,0]=4 1381 B8R1.8 CCSc1ccoc1 62a_100011215275_100000210202 [0,0,0,0,1,0|3,0,0]=4 1382 B8R1.8 CCSc1ccon1 62a_100000210202_100009818083 [0,0,0,0,1,0|3,0,0]=4 1383 B8R1.8 CCSc1ccon1 62a_100009818083_100000210202 [0,0,0,0,1,0|3,0,0]=4 1384 B8R1.8 CCSc1ccsc1 62a_100000210202_100000738268 [0,0,0,0,1,0|3,0,0]=4 1385 B8R1.8 CCSc1ccsc1 62a_100000738268_100000210202 [0,0,0,0,1,0|3,0,0]=4 1386 B8R1.8 CCSc1ccsn1 62a_100000210202_100009818082 [0,0,0,0,1,0|3,0,0]=4 1387 B8R1.8 CCSc1ccsn1 62a_100009818082_100000210202 [0,0,0,0,1,0|3,0,0]=4 1388 B8R1.8 CCSc1cn[nH]c1 62a_100000210202_100000238712 [0,0,0,0,1,0|3,0,0]=4 1389 B8R1.8 CCSc1cn[nH]c1 62a_100000238712_100000210202 [0,0,0,0,1,0|3,0,0]=4 1390 B8R1.8 CCSc1cnco1 62a_100000210202_100020591547 [0,0,0,0,1,0|3,0,0]=4 1391 B8R1.8 CCSc1cnco1 62a_100020591547_100000210202 [0,0,0,0,1,0|3,0,0]=4 1392 B8R1.8 CCSc1cncs1 62a_100000210202_100011934649 [0,0,0,0,1,0|3,0,0]=4 1393 B8R1.8 CCSc1cncs1 62a_100011934649_100000210202 [0,0,0,0,1,0|3,0,0]=4 1394 B8R1.8 CCSc1cnoc1 62a_100000210202_100009815712 [0,0,0,0,1,0|3,0,0]=4 1395 B8R1.8 CCSc1cnoc1 62a_100009815712_100000210202 [0,0,0,0,1,0|3,0,0]=4 1396 B8R1.8 CCSc1cnsc1 62a_100000210202_100009815736 [0,0,0,0,1,0|3,0,0]=4 1397 B8R1.8 CCSc1cnsc1 62a_100009815736_100000210202 [0,0,0,0,1,0|3,0,0]=4 1398 B8R1.8 CCSc1cscn1 62a_100000210202_100000751502 [0,0,0,0,1,0|3,0,0]=4 1399 B8R1.8 CCSc1cscn1 62a_100000751502_100000210202 [0,0,0,0,1,0|3,0,0]=4 1400 B8R1.8 CCSc1nc[nH]n1 62a_100000210202_100000761765 [0,0,0,0,1,0|3,0,0]=4 1401 B8R1.8 CCSc1nc[nH]n1 62a_100000761765_100000210202 [0,0,0,0,1,0|3,0,0]=4 1402 B8R1.8 CCSc1ncc[nH]1 62a_100000210202_100025796157 [0,0,0,0,1,0|2,0,1]=4 1403 B8R1.8 CCSc1ncc[nH]1 62a_100025796157_100000210202 [0,0,0,0,1,0|2,0,1]=4 1404 B8R1.8 CCSc1ncco1 62a_100000210202_100011787736 [0,0,0,0,1,0|3,0,0]=4 1405 B8R1.8 CCSc1ncco1 62a_100011787736_100000210202 [0,0,0,0,1,0|3,0,0]=4 1406 B8R1.8 CCSc1nccs1 62a_100000210202_100000211983 [0,0,0,0,1,0|3,0,0]=4 1407 B8R1.8 CCSc1nccs1 62a_100000211983_100000210202 [0,0,0,0,1,0|3,0,0]=4 1408 B8R1.8 CCSc1ncns1 62a_100000210202_100000693119 [0,0,0,0,1,0|3,0,0]=4 1409 B8R1.8 CCSc1ncns1 62a_100000693119_100000210202 [0,0,0,0,1,0|3,0,0]=4 1410 B8R1.8 CNCc1c[nH]cn1 2230a_106832991635_100000707719 [0,0,0,0,1,0|2,0,1]=4 1411 B8R1.8 CNCc1c[nH]cn1 34a_100102657272_100000707719 [0,0,0,0,1,0|2,0,1]=4 1412 B8R1.8 CNCc1cc[nH]n1 207a_100102657272_100000738523 [0,0,0,0,1,0|3,0,0]=4 1413 B8R1.8 CNCc1cc[nH]n1 270004a_106832991635_100000738523 [0,0,0,0,1,0|3,0,0]=4 1414 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [0,0,0,0,1,0|3,0,0]=4 1415 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [0,0,0,0,1,0|3,0,0]=4 1416 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [0,0,0,0,1,0|3,0,0]=4 1417 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [0,0,0,0,1,0|3,0,0]=4 1418 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [0,0,0,0,1,0|3,0,0]=4 1419 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [0,0,0,0,1,0|3,0,0]=4 1420 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [0,0,0,0,1,0|3,0,0]=4 1421 B8R1.8 CNCc1ccn[nH]1 2230a_106832991635_100000728653 [0,0,0,0,1,0|3,0,0]=4 1422 B8R1.8 CNCc1ccn[nH]1 34a_100102657272_100000728653 [0,0,0,0,1,0|3,0,0]=4 1423 B8R1.8 CNCc1ccn[nH]1 7a_106832991635_100000728653 [0,0,0,0,1,0|3,0,0]=4 1424 B8R1.8 CNCc1ccoc1 207a_100102657272_100011215517 [0,0,0,0,1,0|3,0,0]=4 1425 B8R1.8 CNCc1ccoc1 2230a_100015206860_200000210301 [0,0,0,0,1,0|3,0,0]=4 1426 B8R1.8 CNCc1ccoc1 270004a_106832991635_100011215517 [0,0,0,0,1,0|3,0,0]=4 1427 B8R1.8 CNCc1ccoc1 34a_100015206860_200000210301 [0,0,0,0,1,0|3,0,0]=4 1428 B8R1.8 CNCc1ccon1 2230a_106832991635_100000234950 [0,0,0,0,1,0|3,0,0]=4 1429 B8R1.8 CNCc1ccon1 34a_100102657272_100000234950 [0,0,0,0,1,0|3,0,0]=4 1430 B8R1.8 CNCc1ccon1 7a_106832991635_100000234950 [0,0,0,0,1,0|3,0,0]=4 1431 B8R1.8 CNCc1ccsc1 207a_100102657272_100000188534 [0,0,0,0,1,0|3,0,0]=4 1432 B8R1.8 CNCc1ccsc1 2230a_100000186416_200000210301 [0,0,0,0,1,0|3,0,0]=4 1433 B8R1.8 CNCc1ccsc1 2230a_106832991635_100011261437 [0,0,0,0,1,0|3,0,0]=4 1434 B8R1.8 CNCc1ccsc1 270004a_106832991635_100000188534 [0,0,0,0,1,0|3,0,0]=4 1435 B8R1.8 CNCc1ccsc1 34a_100000186416_200000210301 [0,0,0,0,1,0|3,0,0]=4 1436 B8R1.8 CNCc1ccsc1 34a_100102657272_100011261437 [0,0,0,0,1,0|3,0,0]=4 1437 B8R1.8 CNCc1ccsc1 7a_106832991635_100011261437 [0,0,0,0,1,0|3,0,0]=4 1438 B8R1.8 CNCc1cn[nH]c1 207a_100102657272_100016992096 [0,0,0,0,1,0|3,0,0]=4 1439 B8R1.8 CNCc1cn[nH]c1 270004a_106832991635_100016992096 [0,0,0,0,1,0|3,0,0]=4 1440 B8R1.8 CNCc1cnc[nH]1 207a_100102657272_100000742939 [0,0,0,0,1,0|2,0,1]=4 1441 B8R1.8 CNCc1cnco1 270004a_106832991635_100000064291 [0,0,0,0,1,0|3,0,0]=4 1442 B8R1.8 CNCc1cncs1 207a_100102657272_100000749870 [0,0,0,0,1,0|3,0,0]=4 1443 B8R1.8 CNCc1cncs1 2230a_100016987365_200000210301 [0,0,0,0,1,0|3,0,0]=4 1444 B8R1.8 CNCc1cncs1 2230a_106832991635_100015185245 [0,0,0,0,1,0|3,0,0]=4 1445 B8R1.8 CNCc1cncs1 270004a_106832991635_100000749870 [0,0,0,0,1,0|3,0,0]=4 1446 B8R1.8 CNCc1cncs1 34a_100102657272_100015185245 [0,0,0,0,1,0|3,0,0]=4 1447 B8R1.8 CNCc1cncs1 7a_106832991635_100015185245 [0,0,0,0,1,0|3,0,0]=4 1448 B8R1.8 CNCc1cocn1 270004a_106832991635_100000050382 [0,0,0,0,1,0|3,0,0]=4 1449 B8R1.8 CNCc1cscn1 207a_100102657272_100000743575 [0,0,0,0,1,0|3,0,0]=4 1450 B8R1.8 CNCc1cscn1 2230a_100015185402_200000210301 [0,0,0,0,1,0|3,0,0]=4 1451 B8R1.8 CNCc1cscn1 2230a_106832991635_100000205941 [0,0,0,0,1,0|3,0,0]=4 1452 B8R1.8 CNCc1cscn1 270004a_106832991635_100000743575 [0,0,0,0,1,0|3,0,0]=4 1453 B8R1.8 CNCc1cscn1 34a_100102657272_100000205941 [0,0,0,0,1,0|3,0,0]=4 1454 B8R1.8 CNCc1cscn1 7a_106832991635_100000205941 [0,0,0,0,1,0|3,0,0]=4 1455 B8R1.8 CNCc1ncc[nH]1 207a_100102657272_100000743867 [0,0,0,0,1,0|2,0,1]=4 1456 B8R1.8 CNCc1ncc[nH]1 2230a_106832991635_100016991755 [0,0,0,0,1,0|2,0,1]=4 1457 B8R1.8 CNCc1ncc[nH]1 34a_100102657272_100016991755 [0,0,0,0,1,0|2,0,1]=4 1458 B8R1.8 CNCc1ncc[nH]1 7a_106832991635_100000753453 [0,0,0,0,1,0|2,0,1]=4 1459 B8R1.8 CNCc1ncco1 2230a_100016994969_200000210301 [0,0,0,0,1,0|3,0,0]=4 1460 B8R1.8 CNCc1ncco1 2230a_106832991635_103436540062 [0,0,0,0,1,0|3,0,0]=4 1461 B8R1.8 CNCc1ncco1 270004a_106832991635_100000064290 [0,0,0,0,1,0|3,0,0]=4 1462 B8R1.8 CNCc1ncco1 34a_100102657272_103436540062 [0,0,0,0,1,0|3,0,0]=4 1463 B8R1.8 CNCc1ncco1 7a_106832991635_103436540062 [0,0,0,0,1,0|3,0,0]=4 1464 B8R1.8 CNCc1nccs1 207a_100102657272_100000750902 [0,0,0,0,1,0|3,0,0]=4 1465 B8R1.8 CNCc1nccs1 2230a_100000740555_200000210301 [0,0,0,0,1,0|3,0,0]=4 1466 B8R1.8 CNCc1nccs1 2230a_106832991635_100015184050 [0,0,0,0,1,0|3,0,0]=4 1467 B8R1.8 CNCc1nccs1 270004a_106832991635_100000750902 [0,0,0,0,1,0|3,0,0]=4 1468 B8R1.8 CNCc1nccs1 34a_100102657272_100015184050 [0,0,0,0,1,0|3,0,0]=4 1469 B8R1.8 CNCc1nccs1 7a_106832991635_100015184050 [0,0,0,0,1,0|3,0,0]=4 1470 B8R1.8 CNCc1ncon1 34a_100102657272_100000233494 [0,0,0,0,1,0|3,0,0]=4 1471 B8R1.8 CNCn1cncn1 2230a_106832991635_200020645497 [0,0,0,0,1,0|3,0,0]=4 1472 B8R1.8 CNCn1cncn1 34a_100102657272_200020645497 [0,0,0,0,1,0|3,0,0]=4 1473 B8R1.8 CNCn1cncn1 7a_106832991635_200020645497 [0,0,0,0,1,0|3,0,0]=4 1474 B8R1.8 COCc1c[nH]cn1 34a_100138415774_100000707719 [0,0,0,0,1,0|2,0,1]=4 1475 B8R1.8 COCc1ccco1 34a_100000210059_200000210301 [0,0,0,0,1,0|3,0,0]=4 1476 B8R1.8 COCc1cccs1 34a_100000211240_200000210301 [0,0,0,0,1,0|3,0,0]=4 1477 B8R1.8 COCc1ccn[nH]1 34a_100138415774_100000728653 [0,0,0,0,1,0|3,0,0]=4 1478 B8R1.8 COCc1ccno1 34a_100000740478_200000210301 [0,0,0,0,1,0|3,0,0]=4 1479 B8R1.8 COCc1ccoc1 34a_100011215357_200000210301 [0,0,0,0,1,0|3,0,0]=4 1480 B8R1.8 COCc1ccon1 34a_100138415774_100000234950 [0,0,0,0,1,0|3,0,0]=4 1481 B8R1.8 COCc1ccsc1 34a_100011215551_200000210301 [0,0,0,0,1,0|3,0,0]=4 1482 B8R1.8 COCc1ccsc1 34a_100138415774_100011261437 [0,0,0,0,1,0|3,0,0]=4 1483 B8R1.8 COCc1cncs1 34a_100138415774_100015185245 [0,0,0,0,1,0|3,0,0]=4 1484 B8R1.8 COCc1cscn1 34a_100138415774_100000205941 [0,0,0,0,1,0|3,0,0]=4 1485 B8R1.8 COCc1ncc[nH]1 34a_100138415774_100016991755 [0,0,0,0,1,0|2,0,1]=4 1486 B8R1.8 COCc1ncco1 34a_100000062594_200000210301 [0,0,0,0,1,0|3,0,0]=4 1487 B8R1.8 COCc1ncco1 34a_100138415774_103436540062 [0,0,0,0,1,0|3,0,0]=4 1488 B8R1.8 COCc1nccs1 34a_100138415774_100015184050 [0,0,0,0,1,0|3,0,0]=4 1489 B8R1.8 COCc1ncon1 34a_100138415774_100000233494 [0,0,0,0,1,0|3,0,0]=4 1490 B8R1.8 COCn1cccn1 34a_100000731028_200000210301 [0,0,0,0,1,0|3,0,0]=4 1491 B8R1.8 COCn1cncn1 34a_100138415774_200020645497 [0,0,0,0,1,0|3,0,0]=4 1492 B8R1.8 CSCc1c[nH]cn1 62a_100000707719_200000210301 [0,0,0,0,1,0|2,0,1]=4 1493 B8R1.8 CSCc1c[nH]cn1 62a_200000210301_100000707719 [0,0,0,0,1,0|2,0,1]=4 1494 B8R1.8 CSCc1ccn[nH]1 62a_100000728653_200000210301 [0,0,0,0,1,0|3,0,0]=4 1495 B8R1.8 CSCc1ccn[nH]1 62a_200000210301_100000728653 [0,0,0,0,1,0|3,0,0]=4 1496 B8R1.8 CSCc1ccon1 62a_100000234950_200000210301 [0,0,0,0,1,0|3,0,0]=4 1497 B8R1.8 CSCc1ccon1 62a_200000210301_100000234950 [0,0,0,0,1,0|3,0,0]=4 1498 B8R1.8 CSCc1ccsc1 62a_100011261437_200000210301 [0,0,0,0,1,0|3,0,0]=4 1499 B8R1.8 CSCc1ccsc1 62a_200000210301_100011233845 [0,0,0,0,1,0|3,0,0]=4 1500 B8R1.8 CSCc1cncs1 62a_100015185245_200000210301 [0,0,0,0,1,0|3,0,0]=4 1501 B8R1.8 CSCc1cncs1 62a_200000210301_100015185245 [0,0,0,0,1,0|3,0,0]=4 1502 B8R1.8 CSCc1cscn1 62a_100000205941_200000210301 [0,0,0,0,1,0|3,0,0]=4 1503 B8R1.8 CSCc1cscn1 62a_200000210301_100000205941 [0,0,0,0,1,0|3,0,0]=4 1504 B8R1.8 CSCc1ncc[nH]1 62a_100016991755_200000210301 [0,0,0,0,1,0|2,0,1]=4 1505 B8R1.8 CSCc1ncc[nH]1 62a_200000210301_100016991755 [0,0,0,0,1,0|2,0,1]=4 1506 B8R1.8 CSCc1ncco1 62a_103436540062_200000210301 [0,0,0,0,1,0|3,0,0]=4 1507 B8R1.8 CSCc1ncco1 62a_200000210301_103436540062 [0,0,0,0,1,0|3,0,0]=4 1508 B8R1.8 CSCc1nccs1 62a_100015184050_200000210301 [0,0,0,0,1,0|3,0,0]=4 1509 B8R1.8 CSCc1nccs1 62a_200000210301_100015184050 [0,0,0,0,1,0|3,0,0]=4 1510 B8R1.8 CSCc1ncon1 62a_100000233494_200000210301 [0,0,0,0,1,0|3,0,0]=4 1511 B8R1.8 CSCc1ncon1 62a_200000210301_100000233494 [0,0,0,0,1,0|3,0,0]=4 1512 B8R1.8 CSCn1cncn1 62a_200000210301_200020645497 [0,0,0,0,1,0|3,0,0]=4 1513 B8R1.8 CSCn1cncn1 62a_200020645497_200000210301 [0,0,0,0,1,0|3,0,0]=4 1514 B8R1.8 FCOc1ccsc1 34a_100000106738_100015361967 [0,0,0,0,1,0|3,0,0]=4 1515 B8R1.8 FCOc1ccsc1 7a_100000106738_100015361967 [0,0,0,0,1,0|3,0,0]=4 1516 B8R1.8 FCSc1c[nH]cn1 62a_100000756875_100015361967 [0,0,0,0,1,0|2,0,1]=4 1517 B8R1.8 FCSc1c[nH]cn1 62a_100015361967_100000756875 [0,0,0,0,1,0|2,0,1]=4 1518 B8R1.8 FCSc1cc[nH]n1 62a_100000062575_100015361967 [0,0,0,0,1,0|3,0,0]=4 1519 B8R1.8 FCSc1cc[nH]n1 62a_100015361967_100000062575 [0,0,0,0,1,0|3,0,0]=4 1520 B8R1.8 FCSc1ccco1 62a_100009814098_100015361967 [0,0,0,0,1,0|3,0,0]=4 1521 B8R1.8 FCSc1ccco1 62a_100015361967_100009814098 [0,0,0,0,1,0|3,0,0]=4 1522 B8R1.8 FCSc1cccs1 62a_100011215356_100015361967 [0,0,0,0,1,0|3,0,0]=4 1523 B8R1.8 FCSc1cccs1 62a_100015361967_100011215356 [0,0,0,0,1,0|3,0,0]=4 1524 B8R1.8 FCSc1ccoc1 62a_100011215275_100015361967 [0,0,0,0,1,0|3,0,0]=4 1525 B8R1.8 FCSc1ccoc1 62a_100015361967_100011215275 [0,0,0,0,1,0|3,0,0]=4 1526 B8R1.8 FCSc1ccon1 62a_100009818083_100015361967 [0,0,0,0,1,0|3,0,0]=4 1527 B8R1.8 FCSc1ccon1 62a_100015361967_100009818083 [0,0,0,0,1,0|3,0,0]=4 1528 B8R1.8 FCSc1ccsc1 62a_100000738268_100015361967 [0,0,0,0,1,0|3,0,0]=4 1529 B8R1.8 FCSc1ccsc1 62a_100015361967_100000738268 [0,0,0,0,1,0|3,0,0]=4 1530 B8R1.8 FCSc1ccsn1 62a_100009818082_100015361967 [0,0,0,0,1,0|3,0,0]=4 1531 B8R1.8 FCSc1ccsn1 62a_100015361967_100009818082 [0,0,0,0,1,0|3,0,0]=4 1532 B8R1.8 FCSc1cn[nH]c1 62a_100000238712_100015361967 [0,0,0,0,1,0|3,0,0]=4 1533 B8R1.8 FCSc1cn[nH]c1 62a_100015361967_100000238712 [0,0,0,0,1,0|3,0,0]=4 1534 B8R1.8 FCSc1cnco1 62a_100015361967_100020591547 [0,0,0,0,1,0|3,0,0]=4 1535 B8R1.8 FCSc1cnco1 62a_100020591547_100015361967 [0,0,0,0,1,0|3,0,0]=4 1536 B8R1.8 FCSc1cncs1 62a_100011934649_100015361967 [0,0,0,0,1,0|3,0,0]=4 1537 B8R1.8 FCSc1cncs1 62a_100015361967_100011934649 [0,0,0,0,1,0|3,0,0]=4 1538 B8R1.8 FCSc1cnoc1 62a_100009815712_100015361967 [0,0,0,0,1,0|3,0,0]=4 1539 B8R1.8 FCSc1cnoc1 62a_100015361967_100009815712 [0,0,0,0,1,0|3,0,0]=4 1540 B8R1.8 FCSc1cnsc1 62a_100009815736_100015361967 [0,0,0,0,1,0|3,0,0]=4 1541 B8R1.8 FCSc1cnsc1 62a_100015361967_100009815736 [0,0,0,0,1,0|3,0,0]=4 1542 B8R1.8 FCSc1cscn1 62a_100000751502_100015361967 [0,0,0,0,1,0|3,0,0]=4 1543 B8R1.8 FCSc1cscn1 62a_100015361967_100000751502 [0,0,0,0,1,0|3,0,0]=4 1544 B8R1.8 FCSc1nc[nH]n1 62a_100000761765_100015361967 [0,0,0,0,1,0|3,0,0]=4 1545 B8R1.8 FCSc1nc[nH]n1 62a_100015361967_100000761765 [0,0,0,0,1,0|3,0,0]=4 1546 B8R1.8 FCSc1ncc[nH]1 62a_100015361967_100025796157 [0,0,0,0,1,0|2,0,1]=4 1547 B8R1.8 FCSc1ncc[nH]1 62a_100025796157_100015361967 [0,0,0,0,1,0|2,0,1]=4 1548 B8R1.8 FCSc1ncco1 62a_100011787736_100015361967 [0,0,0,0,1,0|3,0,0]=4 1549 B8R1.8 FCSc1ncco1 62a_100015361967_100011787736 [0,0,0,0,1,0|3,0,0]=4 1550 B8R1.8 FCSc1nccs1 62a_100000211983_100015361967 [0,0,0,0,1,0|3,0,0]=4 1551 B8R1.8 FCSc1nccs1 62a_100015361967_100000211983 [0,0,0,0,1,0|3,0,0]=4 1552 B8R1.8 FCSc1ncns1 62a_100000693119_100015361967 [0,0,0,0,1,0|3,0,0]=4 1553 B8R1.8 FCSc1ncns1 62a_100015361967_100000693119 [0,0,0,0,1,0|3,0,0]=4 1554 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [0,0,0,0,1,0|3,0,0]=4 1555 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [0,0,0,0,1,0|3,0,0]=4 1556 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [0,0,0,0,1,0|3,0,0]=4 1557 B8R1.8 [13CH3]NCc1ccoc1 2230a_100015206860_200025704644 [0,0,0,0,1,0|3,0,0]=4 1558 B8R1.8 [13CH3]NCc1ccoc1 34a_100015206860_200025704644 [0,0,0,0,1,0|3,0,0]=4 1559 B8R1.8 [13CH3]NCc1ccsc1 2230a_100000186416_200025704644 [0,0,0,0,1,0|3,0,0]=4 1560 B8R1.8 [13CH3]NCc1ccsc1 34a_100000186416_200025704644 [0,0,0,0,1,0|3,0,0]=4 1561 B8R1.8 [13CH3]NCc1cncs1 2230a_100016987365_200025704644 [0,0,0,0,1,0|3,0,0]=4 1562 B8R1.8 [13CH3]NCc1cscn1 2230a_100015185402_200025704644 [0,0,0,0,1,0|3,0,0]=4 1563 B8R1.8 [13CH3]NCc1ncco1 2230a_100016994969_200025704644 [0,0,0,0,1,0|3,0,0]=4 1564 B8R1.8 [13CH3]NCc1nccs1 2230a_100000740555_200025704644 [0,0,0,0,1,0|3,0,0]=4 1565 B8R1.8 [13CH3]OCc1ccco1 34a_100000210059_200025704644 [0,0,0,0,1,0|3,0,0]=4 1566 B8R1.8 [13CH3]OCc1cccs1 34a_100000211240_200025704644 [0,0,0,0,1,0|3,0,0]=4 1567 B8R1.8 [13CH3]OCc1ccno1 34a_100000740478_200025704644 [0,0,0,0,1,0|3,0,0]=4 1568 B8R1.8 [13CH3]OCc1ccoc1 34a_100011215357_200025704644 [0,0,0,0,1,0|3,0,0]=4 1569 B8R1.8 [13CH3]OCc1ccsc1 34a_100011215551_200025704644 [0,0,0,0,1,0|3,0,0]=4 1570 B8R1.8 [13CH3]OCc1ncco1 34a_100000062594_200025704644 [0,0,0,0,1,0|3,0,0]=4 1571 B8R1.8 [13CH3]OCn1cccn1 34a_100000731028_200025704644 [0,0,0,0,1,0|3,0,0]=4 1572 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_100000707719_200025704644 [0,0,0,0,1,0|2,0,1]=4 1573 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_200025704644_100000707719 [0,0,0,0,1,0|2,0,1]=4 1574 B8R1.8 [13CH3]SCc1ccn[nH]1 62a_100000728653_200025704644 [0,0,0,0,1,0|3,0,0]=4 1575 B8R1.8 [13CH3]SCc1ccn[nH]1 62a_200025704644_100000728653 [0,0,0,0,1,0|3,0,0]=4 1576 B8R1.8 [13CH3]SCc1ccon1 62a_100000234950_200025704644 [0,0,0,0,1,0|3,0,0]=4 1577 B8R1.8 [13CH3]SCc1ccon1 62a_200025704644_100000234950 [0,0,0,0,1,0|3,0,0]=4 1578 B8R1.8 [13CH3]SCc1ccsc1 62a_100011261437_200025704644 [0,0,0,0,1,0|3,0,0]=4 1579 B8R1.8 [13CH3]SCc1ccsc1 62a_200025704644_100011233845 [0,0,0,0,1,0|3,0,0]=4 1580 B8R1.8 [13CH3]SCc1cncs1 62a_100015185245_200025704644 [0,0,0,0,1,0|3,0,0]=4 1581 B8R1.8 [13CH3]SCc1cncs1 62a_200025704644_100015185245 [0,0,0,0,1,0|3,0,0]=4 1582 B8R1.8 [13CH3]SCc1cscn1 62a_100000205941_200025704644 [0,0,0,0,1,0|3,0,0]=4 1583 B8R1.8 [13CH3]SCc1cscn1 62a_200025704644_100000205941 [0,0,0,0,1,0|3,0,0]=4 1584 B8R1.8 [13CH3]SCc1ncc[nH]1 62a_100016991755_200025704644 [0,0,0,0,1,0|2,0,1]=4 1585 B8R1.8 [13CH3]SCc1ncc[nH]1 62a_200025704644_100016991755 [0,0,0,0,1,0|2,0,1]=4 1586 B8R1.8 [13CH3]SCc1ncco1 62a_103436540062_200025704644 [0,0,0,0,1,0|3,0,0]=4 1587 B8R1.8 [13CH3]SCc1ncco1 62a_200025704644_103436540062 [0,0,0,0,1,0|3,0,0]=4 1588 B8R1.8 [13CH3]SCc1nccs1 62a_100015184050_200025704644 [0,0,0,0,1,0|3,0,0]=4 1589 B8R1.8 [13CH3]SCc1nccs1 62a_200025704644_100015184050 [0,0,0,0,1,0|3,0,0]=4 1590 B8R1.8 [13CH3]SCc1ncon1 62a_100000233494_200025704644 [0,0,0,0,1,0|3,0,0]=4 1591 B8R1.8 [13CH3]SCc1ncon1 62a_200025704644_100000233494 [0,0,0,0,1,0|3,0,0]=4 1592 B8R1.8 [13CH3]SCn1cncn1 62a_200020645497_200025704644 [0,0,0,0,1,0|3,0,0]=4 1593 B8R1.8 [13CH3]SCn1cncn1 62a_200025704644_200020645497 [0,0,0,0,1,0|3,0,0]=4 1594 B7R0.3 C=CC=CC(=O)CC 1458a_100016291481_100000210202 [1,0,1,0,0,0|2,0,0]=4 1595 B7R1.3 Oc1ccccn1 271570a_203496583355_100011216584 [2,0,0,0,0,0|1,1,0]=4 1596 B7R1.3 Oc1cccnc1 271570a_203496583355_100000752921 [2,0,0,0,0,0|1,1,0]=4 1597 B7R1.3 Oc1cnccn1 271570a_203496583355_100000758340 [2,0,0,0,0,0|0,1,0]=3 1598 B9R0.18 C=CC=CC(=O)CCSC 1458a_100016291481_100000751147 [0,1,1,0,0,0|2,0,0]=4 1599 B9R1.1 C=Cc1cnc(cn1)C 271570a_100011290941_100011999403 [1,1,0,0,0,0|0,0,2]=4 1600 B9R1.1 C=Cc1cnc(cn1)F 271570a_100011290941_100009856528 [1,1,0,0,0,0|0,0,2]=4 1601 B9R1.1 C=Cc1cnc(cn1)N 271570a_100011290941_100000761932 [1,1,0,0,0,0|0,0,2]=4 1602 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [1,1,0,0,0,0|1,0,0]=3 1604 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,1,0,0,0,0|1,0,0]=3 1605 B9R1.1 CCc1cnc(nc1)O 271570a_203496583355_100000033099 [1,1,0,0,0,0|2,0,0]=4 1606 B9R1.1 CNc1ccc(cn1)Br 27a_100102657272_100000686858 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.1 CNc1cnc(cn1)Br 27a_100102657272_100010187541 [1,1,0,0,0,0|1,0,0]=3 1610 B9R1.1 CNc1cnc(cn1)C 27a_100102657272_100000074397 [1,1,0,0,0,0|1,0,0]=3 1611 B9R1.1 CNc1cnc(cn1)F 27a_100102657272_100009856528 [1,1,0,0,0,0|1,0,0]=3 1612 B9R1.1 CNc1cnc(cn1)O 271570a_203496583355_100012000640 [1,1,0,0,0,0|1,0,0]=3 1613 B9R1.1 CNc1cnc(nn1)N 27a_100102657272_100000691435 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.1 COc1ccc(cn1)Cl 34a_100011215309_200000210301 [1,1,0,0,0,0|2,0,0]=4 1616 B9R1.1 COc1ccc(cn1)F 34a_100000742473_200000210301 [1,1,0,0,0,0|2,0,0]=4 1617 B9R1.1 COc1ccc(cn1)N 34a_100000729260_200000210301 [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.1 COc1ccc(nc1)Br 34a_100000685995_200000210301 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.1 COc1ccc(nc1)Br 7a_100000685995_200000210301 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,1,0,0,0,0|2,0,0]=4 1623 B9R1.1 COc1ccc(nc1)Cl 34a_100000744096_200000210301 [1,1,0,0,0,0|2,0,0]=4 1624 B9R1.1 COc1ccc(nc1)Cl 7a_100000744096_200000210301 [1,1,0,0,0,0|2,0,0]=4 1625 B9R1.1 COc1ccc(nc1)F 34a_100000688820_200000210301 [1,1,0,0,0,0|2,0,0]=4 1626 B9R1.1 COc1ccc(nc1)F 7a_100000688820_200000210301 [1,1,0,0,0,0|2,0,0]=4 1627 B9R1.1 COc1ccc(nc1)I 34a_100000687607_200000210301 [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.1 COc1ccc(nc1)I 7a_100000687607_200000210301 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.1 COc1ccc(nc1)N 34a_100015188713_200000210301 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.1 COc1ccc(nc1)N 7a_100015188713_200000210301 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [1,1,0,0,0,0|2,0,0]=4 1632 B9R1.1 COc1cnc(cn1)Br 34a_100011934580_200000210301 [1,1,0,0,0,0|1,0,0]=3 1633 B9R1.1 COc1cnc(cn1)Cl 34a_100015839800_200000210301 [1,1,0,0,0,0|1,0,0]=3 1634 B9R1.1 COc1cnc(cn1)O 271570a_203496583355_100011998698 [1,1,0,0,0,0|1,0,0]=3 1635 B9R1.1 CSc1ccc(cn1)Br 62a_100000686858_200000210301 [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.1 CSc1ccc(cn1)Br 62a_200000210301_100000686858 [1,1,0,0,0,0|2,0,0]=4 1637 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.1 CSc1ccc(cn1)Cl 62a_100011356976_200000210301 [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.1 CSc1ccc(cn1)Cl 62a_200000210301_100011356976 [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.1 CSc1ccc(cn1)F 62a_100000744514_200000210301 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.1 CSc1ccc(cn1)F 62a_200000210301_100000744514 [1,1,0,0,0,0|2,0,0]=4 1643 B9R1.1 CSc1ccc(cn1)N 62a_100000737798_200000210301 [1,1,0,0,0,0|2,0,0]=4 1644 B9R1.1 CSc1ccc(cn1)N 62a_200000210301_100000737798 [1,1,0,0,0,0|2,0,0]=4 1645 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.1 CSc1ccc(nc1)Br 62a_100009814638_200000210301 [1,1,0,0,0,0|2,0,0]=4 1649 B9R1.1 CSc1ccc(nc1)Br 62a_200000210301_100009814638 [1,1,0,0,0,0|2,0,0]=4 1650 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,1,0,0,0,0|2,0,0]=4 1651 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,1,0,0,0,0|2,0,0]=4 1652 B9R1.1 CSc1ccc(nc1)Cl 62a_100000034144_200000210301 [1,1,0,0,0,0|2,0,0]=4 1653 B9R1.1 CSc1ccc(nc1)Cl 62a_200000210301_100000034144 [1,1,0,0,0,0|2,0,0]=4 1654 B9R1.1 CSc1ccc(nc1)F 62a_100000042367_200000210301 [1,1,0,0,0,0|2,0,0]=4 1655 B9R1.1 CSc1ccc(nc1)F 62a_200000210301_100000042367 [1,1,0,0,0,0|2,0,0]=4 1656 B9R1.1 CSc1ccc(nc1)N 62a_100000187370_200000210301 [1,1,0,0,0,0|2,0,0]=4 1657 B9R1.1 CSc1ccc(nc1)N 62a_200000210301_100000187370 [1,1,0,0,0,0|2,0,0]=4 1658 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [1,1,0,0,0,0|2,0,0]=4 1659 B9R1.1 CSc1cnc(cn1)Br 62a_100010187541_200000210301 [1,1,0,0,0,0|1,0,0]=3 1660 B9R1.1 CSc1cnc(cn1)Br 62a_200000210301_100010187541 [1,1,0,0,0,0|1,0,0]=3 1661 B9R1.1 CSc1cnc(cn1)C 62a_100011999403_200000210301 [1,1,0,0,0,0|1,0,0]=3 1662 B9R1.1 CSc1cnc(cn1)C 62a_200000210301_100011999403 [1,1,0,0,0,0|1,0,0]=3 1663 B9R1.1 CSc1cnc(cn1)Cl 62a_100010214907_200000210301 [1,1,0,0,0,0|1,0,0]=3 1664 B9R1.1 CSc1cnc(cn1)Cl 62a_200000210301_100010214907 [1,1,0,0,0,0|1,0,0]=3 1665 B9R1.1 CSc1cnc(cn1)F 62a_100009856528_200000210301 [1,1,0,0,0,0|1,0,0]=3 1666 B9R1.1 CSc1cnc(cn1)F 62a_200000210301_100009856528 [1,1,0,0,0,0|1,0,0]=3 1667 B9R1.1 CSc1cnc(cn1)N 62a_100000744751_200000210301 [1,1,0,0,0,0|1,0,0]=3 1668 B9R1.1 CSc1cnc(cn1)N 62a_200000210301_100000744751 [1,1,0,0,0,0|1,0,0]=3 1669 B9R1.1 CSc1cnc(cn1)O 271570a_203496583355_200012356277 [1,1,0,0,0,0|1,0,0]=3 1670 B9R1.1 CSc1cnc(cn1)O 62a_100011934580_200000210301 [1,1,0,0,0,0|1,0,0]=3 1671 B9R1.1 CSc1cnc(cn1)O 62a_200000210301_100015839800 [1,1,0,0,0,0|1,0,0]=3 1672 B9R1.1 CSc1cnc(nn1)N 62a_100000691435_200000210301 [1,1,0,0,0,0|2,0,0]=4 1673 B9R1.1 CSc1cnc(nn1)N 62a_200000210301_100000691435 [1,1,0,0,0,0|2,0,0]=4 1674 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,1,0,0,0,0|2,0,0]=4 1680 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,1,0,0,0,0|2,0,0]=4 1681 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_100011999403_200025704644 [1,1,0,0,0,0|1,0,0]=3 1682 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_200025704644_100011999403 [1,1,0,0,0,0|1,0,0]=3 1683 B9R1.1 N#Cc1cnc(cn1)O 271570a_203496583355_100000059812 [1,1,0,0,0,0|1,0,1]=4 1684 B9R1.1 NCc1ccc(cn1)O 271570a_203496583355_100015188789 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.1 NCc1ccc(nc1)O 271570a_203496583355_100009817727 [1,1,0,0,0,0|2,0,0]=4 1686 B9R1.1 NNc1cnc(cn1)O 271570a_203496583355_100000121042 [1,1,0,0,0,0|2,0,0]=4 1687 B9R1.1 O=Cc1cnc(cn1)O 271570a_203496583355_100012001714 [1,1,0,0,0,0|0,1,1]=4 1688 B9R1.1 OCc1ccc(cn1)O 271570a_203496583355_100000754261 [1,1,0,0,0,0|1,1,0]=4 1689 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [1,1,0,0,0,0|1,1,0]=4 1690 B9R1.1 OCc1cnc(cn1)O 271570a_203496583355_100012002382 [1,1,0,0,0,0|0,1,0]=3 1691 B9R1.1 [13CH3]Oc1ccc(cn1)Cl 34a_100011215309_200025704644 [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.1 [13CH3]Oc1ccc(cn1)F 34a_100000742473_200025704644 [1,1,0,0,0,0|2,0,0]=4 1693 B9R1.1 [13CH3]Oc1ccc(cn1)N 34a_100000729260_200025704644 [1,1,0,0,0,0|2,0,0]=4 1694 B9R1.1 [13CH3]Oc1ccc(nc1)Br 34a_100000685995_200025704644 [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.1 [13CH3]Oc1ccc(nc1)Br 7a_100000685995_200025704644 [1,1,0,0,0,0|2,0,0]=4 1696 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 34a_100000744096_200025704644 [1,1,0,0,0,0|2,0,0]=4 1697 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 7a_100000744096_200025704644 [1,1,0,0,0,0|2,0,0]=4 1698 B9R1.1 [13CH3]Oc1ccc(nc1)F 34a_100000688820_200025704644 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.1 [13CH3]Oc1ccc(nc1)F 7a_100000688820_200025704644 [1,1,0,0,0,0|2,0,0]=4 1700 B9R1.1 [13CH3]Oc1ccc(nc1)I 34a_100000687607_200025704644 [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.1 [13CH3]Oc1ccc(nc1)I 7a_100000687607_200025704644 [1,1,0,0,0,0|2,0,0]=4 1702 B9R1.1 [13CH3]Oc1ccc(nc1)N 34a_100015188713_200025704644 [1,1,0,0,0,0|2,0,0]=4 1703 B9R1.1 [13CH3]Oc1ccc(nc1)N 7a_100015188713_200025704644 [1,1,0,0,0,0|2,0,0]=4 1704 B9R1.1 [13CH3]Oc1cnc(cn1)Br 34a_100011934580_200025704644 [1,1,0,0,0,0|1,0,0]=3 1705 B9R1.1 [13CH3]Oc1cnc(cn1)Cl 34a_100015839800_200025704644 [1,1,0,0,0,0|1,0,0]=3 1706 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_100000686858_200025704644 [1,1,0,0,0,0|2,0,0]=4 1707 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_200025704644_100000686858 [1,1,0,0,0,0|2,0,0]=4 1708 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_100011356976_200025704644 [1,1,0,0,0,0|2,0,0]=4 1709 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_200025704644_100011356976 [1,1,0,0,0,0|2,0,0]=4 1710 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_100000744514_200025704644 [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_200025704644_100000744514 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_100000737798_200025704644 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_200025704644_100000737798 [1,1,0,0,0,0|2,0,0]=4 1714 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [1,1,0,0,0,0|2,0,0]=4 1715 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [1,1,0,0,0,0|2,0,0]=4 1716 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_100009814638_200025704644 [1,1,0,0,0,0|2,0,0]=4 1717 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_200025704644_100009814638 [1,1,0,0,0,0|2,0,0]=4 1718 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_100000034144_200025704644 [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_200025704644_100000034144 [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_100000042367_200025704644 [1,1,0,0,0,0|2,0,0]=4 1721 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_200025704644_100000042367 [1,1,0,0,0,0|2,0,0]=4 1722 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_100000187370_200025704644 [1,1,0,0,0,0|2,0,0]=4 1723 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_200025704644_100000187370 [1,1,0,0,0,0|2,0,0]=4 1724 B9R1.1 [13CH3]Sc1cnc(cn1)Br 62a_100010187541_200025704644 [1,1,0,0,0,0|1,0,0]=3 1725 B9R1.1 [13CH3]Sc1cnc(cn1)Br 62a_200025704644_100010187541 [1,1,0,0,0,0|1,0,0]=3 1726 B9R1.1 [13CH3]Sc1cnc(cn1)Cl 62a_100010214907_200025704644 [1,1,0,0,0,0|1,0,0]=3 1727 B9R1.1 [13CH3]Sc1cnc(cn1)Cl 62a_200025704644_100010214907 [1,1,0,0,0,0|1,0,0]=3 1728 B9R1.1 [13CH3]Sc1cnc(cn1)F 62a_100009856528_200025704644 [1,1,0,0,0,0|1,0,0]=3 1729 B9R1.1 [13CH3]Sc1cnc(cn1)F 62a_200025704644_100009856528 [1,1,0,0,0,0|1,0,0]=3 1730 B9R1.1 [13CH3]Sc1cnc(cn1)N 62a_100000744751_200025704644 [1,1,0,0,0,0|1,0,0]=3 1731 B9R1.1 [13CH3]Sc1cnc(cn1)N 62a_200025704644_100000744751 [1,1,0,0,0,0|1,0,0]=3 1732 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_100011934580_200025704644 [1,1,0,0,0,0|1,0,0]=3 1733 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_200025704644_100015839800 [1,1,0,0,0,0|1,0,0]=3 1734 B9R1.1 [13CH3]Sc1cnc(nn1)N 62a_100000691435_200025704644 [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.1 [13CH3]Sc1cnc(nn1)N 62a_200025704644_100000691435 [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.2 C=Cc1cncc(n1)C 271570a_100011290941_100009842155 [1,1,0,0,0,0|0,0,2]=4 1737 B9R1.2 C=Cc1cncc(n1)F 271570a_100011290941_200009863489 [1,1,0,0,0,0|0,0,2]=4 1738 B9R1.2 C=Cc1cncc(n1)N 271570a_100011290941_100009819714 [1,1,0,0,0,0|0,0,2]=4 1739 B9R1.2 C=Cc1cncc(n1)O 271570a_100011290941_100011269956 [1,1,0,0,0,0|0,0,2]=4 1740 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [1,1,0,0,0,0|1,0,0]=3 1741 B9R1.2 CCc1cc(ncn1)O 271570a_203496583355_100000744278 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [1,1,0,0,0,0|2,0,0]=4 1743 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [1,1,0,0,0,0|1,0,0]=3 1744 B9R1.2 CCc1ccnc(n1)O 271570a_203496583355_100000100215 [1,1,0,0,0,0|2,0,0]=4 1745 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [1,1,0,0,0,0|1,0,0]=3 1746 B9R1.2 CNc1c[n+](ccn1)[O-] 27a_100102657272_100009880115 [1,1,0,0,0,0|1,0,1]=4 1747 B9R1.2 CNc1cc(ccn1)F 27a_100102657272_100000764206 [1,1,0,0,0,0|2,0,0]=4 1748 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [1,1,0,0,0,0|2,0,0]=4 1749 B9R1.2 CNc1cccc(n1)F 27a_100102657272_100009815982 [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [1,1,0,0,0,0|2,0,0]=4 1751 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [1,1,0,0,0,0|2,0,0]=4 1752 B9R1.2 CNc1cncc(n1)C 27a_100102657272_100000754123 [1,1,0,0,0,0|1,0,0]=3 1753 B9R1.2 CNc1cncc(n1)Cl 27a_100102657272_100010892449 [1,1,0,0,0,0|1,0,0]=3 1754 B9R1.2 CNc1cncc(n1)F 27a_100102657272_200009863489 [1,1,0,0,0,0|1,0,0]=3 1755 B9R1.2 CNc1cncc(n1)O 271570a_203496583355_100011529438 [1,1,0,0,0,0|1,0,0]=3 1756 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.2 COc1cccc(n1)F 34a_100011432558_200000210301 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.2 COc1cccc(n1)O 271570a_203496583355_100000760917 [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.2 COc1cncc(c1)Br 34a_100000754920_200000210301 [1,1,0,0,0,0|2,0,0]=4 1760 B9R1.2 COc1cncc(c1)Br 7a_100000754920_200000210301 [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.2 COc1cncc(c1)Cl 7a_100000032511_200000210301 [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.2 COc1cncc(c1)F 34a_100011830296_200000210301 [1,1,0,0,0,0|2,0,0]=4 1765 B9R1.2 COc1cncc(c1)F 7a_100011830296_200000210301 [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.2 COc1cncc(c1)N 34a_100011997051_200000210301 [1,1,0,0,0,0|2,0,0]=4 1767 B9R1.2 COc1cncc(c1)O 271570a_203496583355_100000684773 [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.2 COc1cncc(n1)O 271570a_203496583355_100000756030 [1,1,0,0,0,0|1,0,0]=3 1769 B9R1.2 CSc1c[n+](ccn1)[O-] 62a_200000210301_100009880115 [1,1,0,0,0,0|1,0,1]=4 1770 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [1,1,0,0,0,0|2,0,0]=4 1771 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [1,1,0,0,0,0|2,0,0]=4 1772 B9R1.2 CSc1cc(ccn1)Cl 62a_100010167805_200000210301 [1,1,0,0,0,0|2,0,0]=4 1773 B9R1.2 CSc1cc(ccn1)Cl 62a_200000210301_100010167805 [1,1,0,0,0,0|2,0,0]=4 1774 B9R1.2 CSc1cc(ccn1)F 62a_100000764206_200000210301 [1,1,0,0,0,0|2,0,0]=4 1775 B9R1.2 CSc1cc(ccn1)F 62a_200000210301_100000764206 [1,1,0,0,0,0|2,0,0]=4 1776 B9R1.2 CSc1cc(ccn1)N 62a_100009814236_200000210301 [1,1,0,0,0,0|2,0,0]=4 1777 B9R1.2 CSc1cc(ccn1)N 62a_200000210301_100009814236 [1,1,0,0,0,0|2,0,0]=4 1778 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [1,1,0,0,0,0|2,0,0]=4 1779 B9R1.2 CSc1cccc(n1)Br 62a_100000684672_200000210301 [1,1,0,0,0,0|2,0,0]=4 1780 B9R1.2 CSc1cccc(n1)Br 62a_200000210301_100000684672 [1,1,0,0,0,0|2,0,0]=4 1781 B9R1.2 CSc1cccc(n1)C 62a_100000742759_200000210301 [1,1,0,0,0,0|2,0,0]=4 1782 B9R1.2 CSc1cccc(n1)C 62a_200000210301_100000742759 [1,1,0,0,0,0|2,0,0]=4 1783 B9R1.2 CSc1cccc(n1)Cl 62a_100000051397_200000210301 [1,1,0,0,0,0|2,0,0]=4 1784 B9R1.2 CSc1cccc(n1)Cl 62a_200000210301_100000051397 [1,1,0,0,0,0|2,0,0]=4 1785 B9R1.2 CSc1cccc(n1)F 62a_100009815982_200000210301 [1,1,0,0,0,0|2,0,0]=4 1786 B9R1.2 CSc1cccc(n1)F 62a_200000210301_100009815982 [1,1,0,0,0,0|2,0,0]=4 1787 B9R1.2 CSc1cccc(n1)N 62a_100000740741_200000210301 [1,1,0,0,0,0|2,0,0]=4 1788 B9R1.2 CSc1cccc(n1)N 62a_200000210301_100000740741 [1,1,0,0,0,0|2,0,0]=4 1789 B9R1.2 CSc1cccc(n1)O 271570a_203496583355_100011960944 [1,1,0,0,0,0|2,0,0]=4 1790 B9R1.2 CSc1cncc(c1)Br 62a_100000728054_200000210301 [1,1,0,0,0,0|2,0,0]=4 1791 B9R1.2 CSc1cncc(c1)Br 62a_200000210301_100000728054 [1,1,0,0,0,0|2,0,0]=4 1792 B9R1.2 CSc1cncc(c1)C 62a_100000760492_200000210301 [1,1,0,0,0,0|2,0,0]=4 1793 B9R1.2 CSc1cncc(c1)C 62a_200000210301_100000760492 [1,1,0,0,0,0|2,0,0]=4 1794 B9R1.2 CSc1cncc(c1)Cl 62a_100000049639_200000210301 [1,1,0,0,0,0|2,0,0]=4 1795 B9R1.2 CSc1cncc(c1)Cl 62a_200000210301_100000049639 [1,1,0,0,0,0|2,0,0]=4 1796 B9R1.2 CSc1cncc(c1)F 62a_100000744099_200000210301 [1,1,0,0,0,0|2,0,0]=4 1797 B9R1.2 CSc1cncc(c1)F 62a_200000210301_100000744099 [1,1,0,0,0,0|2,0,0]=4 1798 B9R1.2 CSc1cncc(c1)N 62a_100000687067_200000210301 [1,1,0,0,0,0|2,0,0]=4 1799 B9R1.2 CSc1cncc(c1)N 62a_200000210301_100000687067 [1,1,0,0,0,0|2,0,0]=4 1800 B9R1.2 CSc1cncc(c1)O 271570a_203496583355_100009816972 [1,1,0,0,0,0|2,0,0]=4 1801 B9R1.2 CSc1cncc(c1)O 62a_100000754920_200000210301 [1,1,0,0,0,0|2,0,0]=4 1802 B9R1.2 CSc1cncc(c1)O 62a_200000210301_100000754920 [1,1,0,0,0,0|2,0,0]=4 1803 B9R1.2 CSc1cncc(n1)C 62a_100000754123_200000210301 [1,1,0,0,0,0|1,0,0]=3 1804 B9R1.2 CSc1cncc(n1)C 62a_200000210301_100000754123 [1,1,0,0,0,0|1,0,0]=3 1805 B9R1.2 CSc1cncc(n1)Cl 62a_100010892449_200000210301 [1,1,0,0,0,0|1,0,0]=3 1806 B9R1.2 CSc1cncc(n1)Cl 62a_200000210301_100010892449 [1,1,0,0,0,0|1,0,0]=3 1807 B9R1.2 CSc1cncc(n1)F 62a_200000210301_200009863489 [1,1,0,0,0,0|1,0,0]=3 1808 B9R1.2 CSc1cncc(n1)F 62a_200009863489_200000210301 [1,1,0,0,0,0|1,0,0]=3 1809 B9R1.2 CSc1cncc(n1)N 62a_100000747728_200000210301 [1,1,0,0,0,0|1,0,0]=3 1810 B9R1.2 CSc1cncc(n1)N 62a_200000210301_100000747728 [1,1,0,0,0,0|1,0,0]=3 1811 B9R1.2 CSc1cncc(n1)O 62a_200000210301_100011269956 [1,1,0,0,0,0|1,0,0]=3 1812 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_100000742759_200025704644 [1,1,0,0,0,0|2,0,0]=4 1813 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_200025704644_100000742759 [1,1,0,0,0,0|2,0,0]=4 1814 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [1,1,0,0,0,0|2,0,0]=4 1815 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [1,1,0,0,0,0|2,0,0]=4 1816 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [1,1,0,0,0,0|2,0,0]=4 1817 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [1,1,0,0,0,0|2,0,0]=4 1818 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_100000760492_200025704644 [1,1,0,0,0,0|2,0,0]=4 1819 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_200025704644_100000760492 [1,1,0,0,0,0|2,0,0]=4 1820 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_100000754123_200025704644 [1,1,0,0,0,0|1,0,0]=3 1821 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_200025704644_100000754123 [1,1,0,0,0,0|1,0,0]=3 1822 B9R1.2 N#Cc1cncc(n1)O 271570a_203496583355_100009817212 [1,1,0,0,0,0|1,0,1]=4 1823 B9R1.2 NCc1cc(ccn1)O 271570a_203496583355_100000085674 [1,1,0,0,0,0|2,0,0]=4 1824 B9R1.2 NCc1cccc(n1)O 271570a_203496583355_100016990191 [1,1,0,0,0,0|2,0,0]=4 1825 B9R1.2 NCc1cncc(c1)O 271570a_203496583355_100011249555 [1,1,0,0,0,0|2,0,0]=4 1826 B9R1.2 NNc1cncc(n1)O 271570a_203496583355_100102525095 [1,1,0,0,0,0|2,0,0]=4 1827 B9R1.2 OCc1cc(ccn1)O 271570a_203496583355_100009819072 [1,1,0,0,0,0|1,1,0]=4 1828 B9R1.2 OCc1cccc(n1)O 271570a_203496583355_100000694195 [1,1,0,0,0,0|1,1,0]=4 1829 B9R1.2 OCc1cncc(c1)O 271570a_203496583355_100011259137 [1,1,0,0,0,0|1,1,0]=4 1830 B9R1.2 OCc1cncc(n1)O 271570a_203496583355_100009853123 [1,1,0,0,0,0|0,1,0]=3 1831 B9R1.2 [13CH3]Oc1cccc(n1)F 34a_100011432558_200025704644 [1,1,0,0,0,0|2,0,0]=4 1832 B9R1.2 [13CH3]Oc1cncc(c1)Br 34a_100000754920_200025704644 [1,1,0,0,0,0|2,0,0]=4 1833 B9R1.2 [13CH3]Oc1cncc(c1)Br 7a_100000754920_200025704644 [1,1,0,0,0,0|2,0,0]=4 1834 B9R1.2 [13CH3]Oc1cncc(c1)Cl 7a_100000032511_200025704644 [1,1,0,0,0,0|2,0,0]=4 1835 B9R1.2 [13CH3]Oc1cncc(c1)F 34a_100011830296_200025704644 [1,1,0,0,0,0|2,0,0]=4 1836 B9R1.2 [13CH3]Oc1cncc(c1)F 7a_100011830296_200025704644 [1,1,0,0,0,0|2,0,0]=4 1837 B9R1.2 [13CH3]Oc1cncc(c1)N 34a_100011997051_200025704644 [1,1,0,0,0,0|2,0,0]=4 1838 B9R1.2 [13CH3]Sc1c[n+](ccn1)[O-] 62a_200025704644_100009880115 [1,1,0,0,0,0|1,0,1]=4 1839 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_100010167805_200025704644 [1,1,0,0,0,0|2,0,0]=4 1840 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_200025704644_100010167805 [1,1,0,0,0,0|2,0,0]=4 1841 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_100000764206_200025704644 [1,1,0,0,0,0|2,0,0]=4 1842 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_200025704644_100000764206 [1,1,0,0,0,0|2,0,0]=4 1843 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_100009814236_200025704644 [1,1,0,0,0,0|2,0,0]=4 1844 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_200025704644_100009814236 [1,1,0,0,0,0|2,0,0]=4 1845 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [1,1,0,0,0,0|2,0,0]=4 1846 B9R1.2 [13CH3]Sc1cccc(n1)Br 62a_100000684672_200025704644 [1,1,0,0,0,0|2,0,0]=4 1847 B9R1.2 [13CH3]Sc1cccc(n1)Br 62a_200025704644_100000684672 [1,1,0,0,0,0|2,0,0]=4 1848 B9R1.2 [13CH3]Sc1cccc(n1)Cl 62a_100000051397_200025704644 [1,1,0,0,0,0|2,0,0]=4 1849 B9R1.2 [13CH3]Sc1cccc(n1)Cl 62a_200025704644_100000051397 [1,1,0,0,0,0|2,0,0]=4 1850 B9R1.2 [13CH3]Sc1cccc(n1)F 62a_100009815982_200025704644 [1,1,0,0,0,0|2,0,0]=4 1851 B9R1.2 [13CH3]Sc1cccc(n1)F 62a_200025704644_100009815982 [1,1,0,0,0,0|2,0,0]=4 1852 B9R1.2 [13CH3]Sc1cccc(n1)N 62a_100000740741_200025704644 [1,1,0,0,0,0|2,0,0]=4 1853 B9R1.2 [13CH3]Sc1cccc(n1)N 62a_200025704644_100000740741 [1,1,0,0,0,0|2,0,0]=4 1854 B9R1.2 [13CH3]Sc1cncc(c1)Br 62a_100000728054_200025704644 [1,1,0,0,0,0|2,0,0]=4 1855 B9R1.2 [13CH3]Sc1cncc(c1)Br 62a_200025704644_100000728054 [1,1,0,0,0,0|2,0,0]=4 1856 B9R1.2 [13CH3]Sc1cncc(c1)Cl 62a_100000049639_200025704644 [1,1,0,0,0,0|2,0,0]=4 1857 B9R1.2 [13CH3]Sc1cncc(c1)Cl 62a_200025704644_100000049639 [1,1,0,0,0,0|2,0,0]=4 1858 B9R1.2 [13CH3]Sc1cncc(c1)F 62a_100000744099_200025704644 [1,1,0,0,0,0|2,0,0]=4 1859 B9R1.2 [13CH3]Sc1cncc(c1)F 62a_200025704644_100000744099 [1,1,0,0,0,0|2,0,0]=4 1860 B9R1.2 [13CH3]Sc1cncc(c1)N 62a_100000687067_200025704644 [1,1,0,0,0,0|2,0,0]=4 1861 B9R1.2 [13CH3]Sc1cncc(c1)N 62a_200025704644_100000687067 [1,1,0,0,0,0|2,0,0]=4 1862 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_100000754920_200025704644 [1,1,0,0,0,0|2,0,0]=4 1863 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_200025704644_100000754920 [1,1,0,0,0,0|2,0,0]=4 1864 B9R1.2 [13CH3]Sc1cncc(n1)Cl 62a_100010892449_200025704644 [1,1,0,0,0,0|1,0,0]=3 1865 B9R1.2 [13CH3]Sc1cncc(n1)Cl 62a_200025704644_100010892449 [1,1,0,0,0,0|1,0,0]=3 1866 B9R1.2 [13CH3]Sc1cncc(n1)F 62a_200009863489_200025704644 [1,1,0,0,0,0|1,0,0]=3 1867 B9R1.2 [13CH3]Sc1cncc(n1)F 62a_200025704644_200009863489 [1,1,0,0,0,0|1,0,0]=3 1868 B9R1.2 [13CH3]Sc1cncc(n1)N 62a_100000747728_200025704644 [1,1,0,0,0,0|1,0,0]=3 1869 B9R1.2 [13CH3]Sc1cncc(n1)N 62a_200025704644_100000747728 [1,1,0,0,0,0|1,0,0]=3 1870 B9R1.2 [13CH3]Sc1cncc(n1)O 62a_200025704644_100011269956 [1,1,0,0,0,0|1,0,0]=3 1871 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,1,0,0,0,0|1,0,1]=4 1872 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,1,0,0,0,0|1,0,1]=4 1873 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [1,1,0,0,0,0|0,0,1]=3 1874 B9R1.6 CN(C)c1cnccn1 27a_100102631434_100000211759 [1,1,0,0,0,0|1,0,0]=3 1875 B9R1.15 C=Cc1nccnc1C 271570a_100011290941_100011999405 [1,1,0,0,0,0|0,0,2]=4 1876 B9R1.15 C=Cc1nccnc1F 271570a_100011290941_200010125657 [1,1,0,0,0,0|0,0,2]=4 1877 B9R1.15 C=Cc1nccnc1N 271570a_100011290941_100000747729 [1,1,0,0,0,0|0,0,2]=4 1878 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,1,0,0,0,0|2,0,0]=4 1879 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,1,0,0,0,0|1,0,0]=3 1880 B9R1.15 CCc1cncnc1O 271570a_203496583355_200000100055 [1,1,0,0,0,0|2,0,0]=4 1881 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [1,1,0,0,0,0|1,0,0]=3 1882 B9R1.15 CCc1nccnc1O 271570a_203496583355_100011995844 [1,1,0,0,0,0|0,0,0]=2 1883 B9R1.15 CCc1ncncc1O 271570a_203496583355_100009816992 [1,1,0,0,0,0|2,0,0]=4 1884 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [1,1,0,0,0,0|2,0,0]=4 1885 B9R1.15 CNc1ncccc1Br 27a_100102657272_100000696092 [1,1,0,0,0,0|2,0,0]=4 1886 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [1,1,0,0,0,0|2,0,0]=4 1887 B9R1.15 CNc1nccnc1C 27a_100102657272_100011999405 [1,1,0,0,0,0|1,0,0]=3 1888 B9R1.15 CNc1nccnc1F 27a_100102657272_200010125657 [1,1,0,0,0,0|1,0,0]=3 1889 B9R1.15 CNc1nccnc1O 271570a_203496583355_100011529439 [1,1,0,0,0,0|1,0,0]=3 1890 B9R1.15 COc1cccnc1Br 34a_100000744436_200000210301 [1,1,0,0,0,0|2,0,0]=4 1891 B9R1.15 COc1cccnc1Br 7a_100000744436_200000210301 [1,1,0,0,0,0|2,0,0]=4 1892 B9R1.15 COc1cccnc1C 34a_100000745507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1893 B9R1.15 COc1cccnc1C 7a_100000745507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1894 B9R1.15 COc1cccnc1Cl 34a_100000757616_200000210301 [1,1,0,0,0,0|2,0,0]=4 1895 B9R1.15 COc1cccnc1Cl 7a_100000757616_200000210301 [1,1,0,0,0,0|2,0,0]=4 1896 B9R1.15 COc1cccnc1F 34a_100000061740_200000210301 [1,1,0,0,0,0|2,0,0]=4 1897 B9R1.15 COc1cccnc1F 7a_100000061740_200000210301 [1,1,0,0,0,0|2,0,0]=4 1898 B9R1.15 COc1cccnc1I 34a_100000034122_200000210301 [1,1,0,0,0,0|2,0,0]=4 1899 B9R1.15 COc1cccnc1I 7a_100000034122_200000210301 [1,1,0,0,0,0|2,0,0]=4 1900 B9R1.15 COc1cccnc1N 34a_100000211975_200000210301 [1,1,0,0,0,0|2,0,0]=4 1901 B9R1.15 COc1cccnc1N 7a_100000211975_200000210301 [1,1,0,0,0,0|2,0,0]=4 1902 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,1,0,0,0,0|2,0,0]=4 1903 B9R1.15 COc1cnccc1C 34a_100011997053_200000210301 [1,1,0,0,0,0|2,0,0]=4 1904 B9R1.15 COc1cnccc1C 7a_100011997053_200000210301 [1,1,0,0,0,0|2,0,0]=4 1905 B9R1.15 COc1cnccc1Cl 34a_100011996695_200000210301 [1,1,0,0,0,0|2,0,0]=4 1906 B9R1.15 COc1cnccc1I 34a_100000050107_200000210301 [1,1,0,0,0,0|2,0,0]=4 1907 B9R1.15 COc1cnccc1N 34a_100000753702_200000210301 [1,1,0,0,0,0|2,0,0]=4 1908 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,1,0,0,0,0|2,0,0]=4 1909 B9R1.15 COc1ncccc1Cl 34a_100011290957_200000210301 [1,1,0,0,0,0|2,0,0]=4 1910 B9R1.15 COc1ncccc1F 34a_100011219419_200000210301 [1,1,0,0,0,0|2,0,0]=4 1911 B9R1.15 COc1ncccc1N 34a_100000746358_200000210301 [1,1,0,0,0,0|2,0,0]=4 1912 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,1,0,0,0,0|2,0,0]=4 1913 B9R1.15 COc1nccnc1C 34a_100000766352_200000210301 [1,1,0,0,0,0|1,0,0]=3 1914 B9R1.15 COc1nccnc1O 271570a_203496583355_100000749998 [1,1,0,0,0,0|1,0,0]=3 1915 B9R1.15 CSc1cccnc1Br 62a_100010202626_200000210301 [1,1,0,0,0,0|2,0,0]=4 1916 B9R1.15 CSc1cccnc1Br 62a_200000210301_100010202626 [1,1,0,0,0,0|2,0,0]=4 1917 B9R1.15 CSc1cccnc1C 62a_100000751574_200000210301 [1,1,0,0,0,0|2,0,0]=4 1918 B9R1.15 CSc1cccnc1C 62a_200000210301_100000751574 [1,1,0,0,0,0|2,0,0]=4 1919 B9R1.15 CSc1cccnc1Cl 62a_100000036424_200000210301 [1,1,0,0,0,0|2,0,0]=4 1920 B9R1.15 CSc1cccnc1Cl 62a_200000210301_100000036424 [1,1,0,0,0,0|2,0,0]=4 1921 B9R1.15 CSc1cccnc1F 62a_100009816115_200000210301 [1,1,0,0,0,0|2,0,0]=4 1922 B9R1.15 CSc1cccnc1F 62a_200000210301_100009816115 [1,1,0,0,0,0|2,0,0]=4 1923 B9R1.15 CSc1cccnc1N 62a_100000045569_200000210301 [1,1,0,0,0,0|2,0,0]=4 1924 B9R1.15 CSc1cccnc1N 62a_200000210301_100000045569 [1,1,0,0,0,0|2,0,0]=4 1925 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [1,1,0,0,0,0|2,0,0]=4 1926 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [1,1,0,0,0,0|2,0,0]=4 1927 B9R1.15 CSc1cnccc1Br 62a_100010138639_200000210301 [1,1,0,0,0,0|2,0,0]=4 1928 B9R1.15 CSc1cnccc1Br 62a_200000210301_100010138639 [1,1,0,0,0,0|2,0,0]=4 1929 B9R1.15 CSc1cnccc1C 62a_100000761580_200000210301 [1,1,0,0,0,0|2,0,0]=4 1930 B9R1.15 CSc1cnccc1C 62a_200000210301_100000761580 [1,1,0,0,0,0|2,0,0]=4 1931 B9R1.15 CSc1cnccc1Cl 62a_100009995489_200000210301 [1,1,0,0,0,0|2,0,0]=4 1932 B9R1.15 CSc1cnccc1Cl 62a_200000210301_100009995489 [1,1,0,0,0,0|2,0,0]=4 1933 B9R1.15 CSc1cnccc1F 62a_100009820683_200000210301 [1,1,0,0,0,0|2,0,0]=4 1934 B9R1.15 CSc1cnccc1F 62a_200000210301_100009820683 [1,1,0,0,0,0|2,0,0]=4 1935 B9R1.15 CSc1cnccc1N 62a_100000047001_200000210301 [1,1,0,0,0,0|2,0,0]=4 1936 B9R1.15 CSc1cnccc1N 62a_200000210301_100000047001 [1,1,0,0,0,0|2,0,0]=4 1937 B9R1.15 CSc1ncc[nH]c1=O 62a_200000210301_100000763361 [1,1,0,0,0,0|1,0,1]=4 1938 B9R1.15 CSc1ncccc1Br 62a_100000696092_200000210301 [1,1,0,0,0,0|2,0,0]=4 1939 B9R1.15 CSc1ncccc1Br 62a_200000210301_100000696092 [1,1,0,0,0,0|2,0,0]=4 1940 B9R1.15 CSc1ncccc1C 62a_100000751373_200000210301 [1,1,0,0,0,0|2,0,0]=4 1941 B9R1.15 CSc1ncccc1C 62a_200000210301_100000751373 [1,1,0,0,0,0|2,0,0]=4 1942 B9R1.15 CSc1ncccc1Cl 62a_100011356963_200000210301 [1,1,0,0,0,0|2,0,0]=4 1943 B9R1.15 CSc1ncccc1Cl 62a_200000210301_100011356963 [1,1,0,0,0,0|2,0,0]=4 1944 B9R1.15 CSc1ncccc1F 62a_100000685392_200000210301 [1,1,0,0,0,0|2,0,0]=4 1945 B9R1.15 CSc1ncccc1F 62a_200000210301_100000685392 [1,1,0,0,0,0|2,0,0]=4 1946 B9R1.15 CSc1ncccc1N 62a_100000688686_200000210301 [1,1,0,0,0,0|2,0,0]=4 1947 B9R1.15 CSc1ncccc1N 62a_200000210301_100000688686 [1,1,0,0,0,0|2,0,0]=4 1948 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [1,1,0,0,0,0|2,0,0]=4 1949 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [1,1,0,0,0,0|2,0,0]=4 1950 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [1,1,0,0,0,0|2,0,0]=4 1951 B9R1.15 CSc1nccnc1C 62a_100011999405_200000210301 [1,1,0,0,0,0|1,0,0]=3 1952 B9R1.15 CSc1nccnc1C 62a_200000210301_100011999405 [1,1,0,0,0,0|1,0,0]=3 1953 B9R1.15 CSc1nccnc1Cl 62a_100010886584_200000210301 [1,1,0,0,0,0|1,0,0]=3 1954 B9R1.15 CSc1nccnc1Cl 62a_200000210301_100010886584 [1,1,0,0,0,0|1,0,0]=3 1955 B9R1.15 CSc1nccnc1F 62a_200000210301_200010125657 [1,1,0,0,0,0|1,0,0]=3 1956 B9R1.15 CSc1nccnc1F 62a_200010125657_200000210301 [1,1,0,0,0,0|1,0,0]=3 1957 B9R1.15 CSc1nccnc1N 62a_100000747729_200000210301 [1,1,0,0,0,0|1,0,0]=3 1958 B9R1.15 CSc1nccnc1N 62a_200000210301_100000747729 [1,1,0,0,0,0|1,0,0]=3 1959 B9R1.15 Cc1cccnc1S[13CH3] 62a_100000751373_200025704644 [1,1,0,0,0,0|2,0,0]=4 1960 B9R1.15 Cc1cccnc1S[13CH3] 62a_200025704644_100000751373 [1,1,0,0,0,0|2,0,0]=4 1961 B9R1.15 Cc1ccncc1O[13CH3] 34a_100011997053_200025704644 [1,1,0,0,0,0|2,0,0]=4 1962 B9R1.15 Cc1ccncc1O[13CH3] 7a_100011997053_200025704644 [1,1,0,0,0,0|2,0,0]=4 1963 B9R1.15 Cc1ccncc1S[13CH3] 62a_100000761580_200025704644 [1,1,0,0,0,0|2,0,0]=4 1964 B9R1.15 Cc1ccncc1S[13CH3] 62a_200025704644_100000761580 [1,1,0,0,0,0|2,0,0]=4 1965 B9R1.15 Cc1ncccc1O[13CH3] 34a_100000745507_200025704644 [1,1,0,0,0,0|2,0,0]=4 1966 B9R1.15 Cc1ncccc1O[13CH3] 7a_100000745507_200025704644 [1,1,0,0,0,0|2,0,0]=4 1967 B9R1.15 Cc1ncccc1S[13CH3] 62a_100000751574_200025704644 [1,1,0,0,0,0|2,0,0]=4 1968 B9R1.15 Cc1ncccc1S[13CH3] 62a_200025704644_100000751574 [1,1,0,0,0,0|2,0,0]=4 1969 B9R1.15 Cc1nccnc1O[13CH3] 34a_100000766352_200025704644 [1,1,0,0,0,0|1,0,0]=3 1970 B9R1.15 Cc1nccnc1S[13CH3] 62a_100011999405_200025704644 [1,1,0,0,0,0|1,0,0]=3 1971 B9R1.15 Cc1nccnc1S[13CH3] 62a_200025704644_100011999405 [1,1,0,0,0,0|1,0,0]=3 1972 B9R1.15 N#Cc1nccnc1O 271570a_203496583355_100000040484 [1,1,0,0,0,0|1,0,1]=4 1973 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [1,1,0,0,0,0|2,0,0]=4 1974 B9R1.15 NCc1ncccc1O 271570a_203496583355_100020591323 [1,1,0,0,0,0|2,0,0]=4 1975 B9R1.15 NCc1nccnc1O 271570a_203496583355_100000729963 [1,1,0,0,0,0|1,0,0]=3 1976 B9R1.15 NNc1nccnc1O 271570a_203496583355_100000755098 [1,1,0,0,0,0|2,0,0]=4 1977 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,1,0,0,0,0|1,1,0]=4 1978 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,1,0,0,0,0|1,1,0]=4 1979 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,1,0,0,0,0|1,1,0]=4 1980 B9R1.15 OCc1nccnc1O 271570a_203496583355_100000057004 [1,1,0,0,0,0|0,1,0]=3 1981 B9R1.15 [13CH3]Oc1cccnc1Br 34a_100000744436_200025704644 [1,1,0,0,0,0|2,0,0]=4 1982 B9R1.15 [13CH3]Oc1cccnc1Br 7a_100000744436_200025704644 [1,1,0,0,0,0|2,0,0]=4 1983 B9R1.15 [13CH3]Oc1cccnc1Cl 34a_100000757616_200025704644 [1,1,0,0,0,0|2,0,0]=4 1984 B9R1.15 [13CH3]Oc1cccnc1Cl 7a_100000757616_200025704644 [1,1,0,0,0,0|2,0,0]=4 1985 B9R1.15 [13CH3]Oc1cccnc1F 34a_100000061740_200025704644 [1,1,0,0,0,0|2,0,0]=4 1986 B9R1.15 [13CH3]Oc1cccnc1F 7a_100000061740_200025704644 [1,1,0,0,0,0|2,0,0]=4 1987 B9R1.15 [13CH3]Oc1cccnc1I 34a_100000034122_200025704644 [1,1,0,0,0,0|2,0,0]=4 1988 B9R1.15 [13CH3]Oc1cccnc1I 7a_100000034122_200025704644 [1,1,0,0,0,0|2,0,0]=4 1989 B9R1.15 [13CH3]Oc1cccnc1N 34a_100000211975_200025704644 [1,1,0,0,0,0|2,0,0]=4 1990 B9R1.15 [13CH3]Oc1cccnc1N 7a_100000211975_200025704644 [1,1,0,0,0,0|2,0,0]=4 1991 B9R1.15 [13CH3]Oc1cnccc1Cl 34a_100011996695_200025704644 [1,1,0,0,0,0|2,0,0]=4 1992 B9R1.15 [13CH3]Oc1cnccc1I 34a_100000050107_200025704644 [1,1,0,0,0,0|2,0,0]=4 1993 B9R1.15 [13CH3]Oc1cnccc1N 34a_100000753702_200025704644 [1,1,0,0,0,0|2,0,0]=4 1994 B9R1.15 [13CH3]Oc1ncccc1Cl 34a_100011290957_200025704644 [1,1,0,0,0,0|2,0,0]=4 1995 B9R1.15 [13CH3]Oc1ncccc1F 34a_100011219419_200025704644 [1,1,0,0,0,0|2,0,0]=4 1996 B9R1.15 [13CH3]Oc1ncccc1N 34a_100000746358_200025704644 [1,1,0,0,0,0|2,0,0]=4 1997 B9R1.15 [13CH3]Sc1cccnc1Br 62a_100010202626_200025704644 [1,1,0,0,0,0|2,0,0]=4 1998 B9R1.15 [13CH3]Sc1cccnc1Br 62a_200025704644_100010202626 [1,1,0,0,0,0|2,0,0]=4 1999 B9R1.15 [13CH3]Sc1cccnc1Cl 62a_100000036424_200025704644 [1,1,0,0,0,0|2,0,0]=4 2000 B9R1.15 [13CH3]Sc1cccnc1Cl 62a_200025704644_100000036424 [1,1,0,0,0,0|2,0,0]=4 2001 B9R1.15 [13CH3]Sc1cccnc1F 62a_100009816115_200025704644 [1,1,0,0,0,0|2,0,0]=4 2002 B9R1.15 [13CH3]Sc1cccnc1F 62a_200025704644_100009816115 [1,1,0,0,0,0|2,0,0]=4 2003 B9R1.15 [13CH3]Sc1cccnc1N 62a_100000045569_200025704644 [1,1,0,0,0,0|2,0,0]=4 2004 B9R1.15 [13CH3]Sc1cccnc1N 62a_200025704644_100000045569 [1,1,0,0,0,0|2,0,0]=4 2005 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [1,1,0,0,0,0|2,0,0]=4 2006 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [1,1,0,0,0,0|2,0,0]=4 2007 B9R1.15 [13CH3]Sc1cnccc1Br 62a_100010138639_200025704644 [1,1,0,0,0,0|2,0,0]=4 2008 B9R1.15 [13CH3]Sc1cnccc1Br 62a_200025704644_100010138639 [1,1,0,0,0,0|2,0,0]=4 2009 B9R1.15 [13CH3]Sc1cnccc1Cl 62a_100009995489_200025704644 [1,1,0,0,0,0|2,0,0]=4 2010 B9R1.15 [13CH3]Sc1cnccc1Cl 62a_200025704644_100009995489 [1,1,0,0,0,0|2,0,0]=4 2011 B9R1.15 [13CH3]Sc1cnccc1F 62a_100009820683_200025704644 [1,1,0,0,0,0|2,0,0]=4 2012 B9R1.15 [13CH3]Sc1cnccc1F 62a_200025704644_100009820683 [1,1,0,0,0,0|2,0,0]=4 2013 B9R1.15 [13CH3]Sc1cnccc1N 62a_100000047001_200025704644 [1,1,0,0,0,0|2,0,0]=4 2014 B9R1.15 [13CH3]Sc1cnccc1N 62a_200025704644_100000047001 [1,1,0,0,0,0|2,0,0]=4 2015 B9R1.15 [13CH3]Sc1ncc[nH]c1=O 62a_200025704644_100000763361 [1,1,0,0,0,0|1,0,1]=4 2016 B9R1.15 [13CH3]Sc1ncccc1Br 62a_100000696092_200025704644 [1,1,0,0,0,0|2,0,0]=4 2017 B9R1.15 [13CH3]Sc1ncccc1Br 62a_200025704644_100000696092 [1,1,0,0,0,0|2,0,0]=4 2018 B9R1.15 [13CH3]Sc1ncccc1Cl 62a_100011356963_200025704644 [1,1,0,0,0,0|2,0,0]=4 2019 B9R1.15 [13CH3]Sc1ncccc1Cl 62a_200025704644_100011356963 [1,1,0,0,0,0|2,0,0]=4 2020 B9R1.15 [13CH3]Sc1ncccc1F 62a_100000685392_200025704644 [1,1,0,0,0,0|2,0,0]=4 2021 B9R1.15 [13CH3]Sc1ncccc1F 62a_200025704644_100000685392 [1,1,0,0,0,0|2,0,0]=4 2022 B9R1.15 [13CH3]Sc1ncccc1N 62a_100000688686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2023 B9R1.15 [13CH3]Sc1ncccc1N 62a_200025704644_100000688686 [1,1,0,0,0,0|2,0,0]=4 2024 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [1,1,0,0,0,0|2,0,0]=4 2025 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [1,1,0,0,0,0|2,0,0]=4 2026 B9R1.15 [13CH3]Sc1nccnc1Cl 62a_100010886584_200025704644 [1,1,0,0,0,0|1,0,0]=3 2027 B9R1.15 [13CH3]Sc1nccnc1Cl 62a_200025704644_100010886584 [1,1,0,0,0,0|1,0,0]=3 2028 B9R1.15 [13CH3]Sc1nccnc1F 62a_200010125657_200025704644 [1,1,0,0,0,0|1,0,0]=3 2029 B9R1.15 [13CH3]Sc1nccnc1F 62a_200025704644_200010125657 [1,1,0,0,0,0|1,0,0]=3 2030 B9R1.15 [13CH3]Sc1nccnc1N 62a_100000747729_200025704644 [1,1,0,0,0,0|1,0,0]=3 2031 B9R1.15 [13CH3]Sc1nccnc1N 62a_200025704644_100000747729 [1,1,0,0,0,0|1,0,0]=3 2032 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [0,1,0,0,1,0|2,0,0]=4 2033 B9R1.7 CCCc1nc(no1)C 270196a_100000212224_100000211992 [0,1,0,0,1,0|2,0,0]=4 2034 B9R1.7 CCCc1ncc([nH]1)O 271570a_203496583355_200009820212 [0,1,0,0,1,0|1,0,1]=4 2035 B9R1.7 CCCc1noc(n1)C 270196a_100011193412_100000070787 [0,1,0,0,1,0|2,0,0]=4 2036 B9R1.7 CCCc1noc(n1)O 270196a_100011193412_100015183105 [0,1,0,0,1,0|2,0,0]=4 2037 B9R1.7 CCCn1cc(cn1)O 271570a_203496583355_100011400188 [0,1,0,0,1,0|2,0,0]=4 2038 B9R1.7 CCCn1ccc(n1)O 271570a_203496583355_100012457951 [0,1,0,0,1,0|2,0,0]=4 2039 B9R1.7 Cc1noc(n1)CCO 270196a_100000212224_100011216618 [0,1,0,0,1,0|1,1,0]=4 2040 B9R1.7 NCCn1cc(cn1)O 271570a_203496583355_100000730845 [0,1,0,0,1,0|2,0,0]=4 2041 B9R1.7 OCCn1cc(cn1)O 271570a_203496583355_100011236722 [0,1,0,0,1,0|1,1,0]=4 2042 B9R1.7 OCCn1ccc(n1)O 271570a_203496583355_200010732121 [0,1,0,0,1,0|1,1,0]=4 2043 B9R1.12 CCCCc1c[nH]cn1 271570a_100020621405_100000756875 [0,1,0,0,1,0|1,0,1]=4 2044 B9R1.12 CCCCc1cc[nH]n1 271570a_100020621405_100000062575 [0,1,0,0,1,0|2,0,0]=4 2045 B9R1.12 CCCCc1ccco1 271570a_100020621405_100009814098 [0,1,0,0,1,0|2,0,0]=4 2046 B9R1.12 CCCCc1cccs1 271570a_100020621405_100011215356 [0,1,0,0,1,0|2,0,0]=4 2047 B9R1.12 CCCCc1ccoc1 271570a_100020621405_100011215275 [0,1,0,0,1,0|2,0,0]=4 2048 B9R1.12 CCCCc1ccsc1 271570a_100020621405_100000738268 [0,1,0,0,1,0|2,0,0]=4 2049 B9R1.12 CCCCc1ccsn1 271570a_100020621405_100009818082 [0,1,0,0,1,0|2,0,0]=4 2050 B9R1.12 CCCCc1cn[nH]c1 271570a_100020621405_100000238712 [0,1,0,0,1,0|2,0,0]=4 2051 B9R1.12 CCCCc1cnco1 271570a_100020621405_100020591547 [0,1,0,0,1,0|2,0,0]=4 2052 B9R1.12 CCCCc1cncs1 271570a_100020621405_100011934649 [0,1,0,0,1,0|2,0,0]=4 2053 B9R1.12 CCCCc1cnoc1 271570a_100020621405_100009815712 [0,1,0,0,1,0|2,0,0]=4 2054 B9R1.12 CCCCc1cnsc1 271570a_100020621405_100009815736 [0,1,0,0,1,0|2,0,0]=4 2055 B9R1.12 CCCCc1cscn1 271570a_100020621405_100000751502 [0,1,0,0,1,0|2,0,0]=4 2056 B9R1.12 CCCCc1nc[nH]n1 271570a_100020621405_100000761765 [0,1,0,0,1,0|2,0,0]=4 2057 B9R1.12 CCCCc1ncc[nH]1 271570a_100020621405_100025796157 [0,1,0,0,1,0|1,0,1]=4 2058 B9R1.12 CCCCc1ncco1 271570a_100020621405_100011787736 [0,1,0,0,1,0|2,0,0]=4 2059 B9R1.12 CCCCc1nccs1 271570a_100020621405_100000211983 [0,1,0,0,1,0|2,0,0]=4 2060 B9R1.12 CCCCc1ncns1 271570a_100020621405_100000693119 [0,1,0,0,1,0|2,0,0]=4 2061 B9R1.12 CCCOc1ccsc1 34a_100000106738_100000210303 [0,1,0,0,1,0|2,0,0]=4 2062 B9R1.12 CCCOc1ccsc1 7a_100000106738_100000210303 [0,1,0,0,1,0|2,0,0]=4 2063 B9R1.12 CCCSc1c[nH]cn1 62a_100000210303_100000756875 [0,1,0,0,1,0|1,0,1]=4 2064 B9R1.12 CCCSc1c[nH]cn1 62a_100000756875_100000210303 [0,1,0,0,1,0|1,0,1]=4 2065 B9R1.12 CCCSc1cc[nH]n1 62a_100000062575_100000210303 [0,1,0,0,1,0|2,0,0]=4 2066 B9R1.12 CCCSc1cc[nH]n1 62a_100000210303_100000062575 [0,1,0,0,1,0|2,0,0]=4 2067 B9R1.12 CCCSc1ccco1 62a_100000210303_100009814098 [0,1,0,0,1,0|2,0,0]=4 2068 B9R1.12 CCCSc1ccco1 62a_100009814098_100000210303 [0,1,0,0,1,0|2,0,0]=4 2069 B9R1.12 CCCSc1cccs1 62a_100000210303_100011215356 [0,1,0,0,1,0|2,0,0]=4 2070 B9R1.12 CCCSc1cccs1 62a_100011215356_100000210303 [0,1,0,0,1,0|2,0,0]=4 2071 B9R1.12 CCCSc1ccoc1 62a_100000210303_100011215275 [0,1,0,0,1,0|2,0,0]=4 2072 B9R1.12 CCCSc1ccoc1 62a_100011215275_100000210303 [0,1,0,0,1,0|2,0,0]=4 2073 B9R1.12 CCCSc1ccon1 62a_100000210303_100009818083 [0,1,0,0,1,0|2,0,0]=4 2074 B9R1.12 CCCSc1ccon1 62a_100009818083_100000210303 [0,1,0,0,1,0|2,0,0]=4 2075 B9R1.12 CCCSc1ccsc1 62a_100000210303_100000738268 [0,1,0,0,1,0|2,0,0]=4 2076 B9R1.12 CCCSc1ccsc1 62a_100000738268_100000210303 [0,1,0,0,1,0|2,0,0]=4 2077 B9R1.12 CCCSc1ccsn1 62a_100000210303_100009818082 [0,1,0,0,1,0|2,0,0]=4 2078 B9R1.12 CCCSc1ccsn1 62a_100009818082_100000210303 [0,1,0,0,1,0|2,0,0]=4 2079 B9R1.12 CCCSc1cn[nH]c1 62a_100000210303_100000238712 [0,1,0,0,1,0|2,0,0]=4 2080 B9R1.12 CCCSc1cn[nH]c1 62a_100000238712_100000210303 [0,1,0,0,1,0|2,0,0]=4 2081 B9R1.12 CCCSc1cnco1 62a_100000210303_100020591547 [0,1,0,0,1,0|2,0,0]=4 2082 B9R1.12 CCCSc1cnco1 62a_100020591547_100000210303 [0,1,0,0,1,0|2,0,0]=4 2083 B9R1.12 CCCSc1cncs1 62a_100000210303_100011934649 [0,1,0,0,1,0|2,0,0]=4 2084 B9R1.12 CCCSc1cncs1 62a_100011934649_100000210303 [0,1,0,0,1,0|2,0,0]=4 2085 B9R1.12 CCCSc1cnoc1 62a_100000210303_100009815712 [0,1,0,0,1,0|2,0,0]=4 2086 B9R1.12 CCCSc1cnoc1 62a_100009815712_100000210303 [0,1,0,0,1,0|2,0,0]=4 2087 B9R1.12 CCCSc1cnsc1 62a_100000210303_100009815736 [0,1,0,0,1,0|2,0,0]=4 2088 B9R1.12 CCCSc1cnsc1 62a_100009815736_100000210303 [0,1,0,0,1,0|2,0,0]=4 2089 B9R1.12 CCCSc1cscn1 62a_100000210303_100000751502 [0,1,0,0,1,0|2,0,0]=4 2090 B9R1.12 CCCSc1cscn1 62a_100000751502_100000210303 [0,1,0,0,1,0|2,0,0]=4 2091 B9R1.12 CCCSc1nc[nH]n1 62a_100000210303_100000761765 [0,1,0,0,1,0|2,0,0]=4 2092 B9R1.12 CCCSc1nc[nH]n1 62a_100000761765_100000210303 [0,1,0,0,1,0|2,0,0]=4 2093 B9R1.12 CCCSc1ncc[nH]1 62a_100000210303_100025796157 [0,1,0,0,1,0|1,0,1]=4 2094 B9R1.12 CCCSc1ncc[nH]1 62a_100025796157_100000210303 [0,1,0,0,1,0|1,0,1]=4 2095 B9R1.12 CCCSc1ncco1 62a_100000210303_100011787736 [0,1,0,0,1,0|2,0,0]=4 2096 B9R1.12 CCCSc1ncco1 62a_100011787736_100000210303 [0,1,0,0,1,0|2,0,0]=4 2097 B9R1.12 CCCSc1nccs1 62a_100000210303_100000211983 [0,1,0,0,1,0|2,0,0]=4 2098 B9R1.12 CCCSc1nccs1 62a_100000211983_100000210303 [0,1,0,0,1,0|2,0,0]=4 2099 B9R1.12 CCCSc1ncns1 62a_100000210303_100000693119 [0,1,0,0,1,0|2,0,0]=4 2100 B9R1.12 CCCSc1ncns1 62a_100000693119_100000210303 [0,1,0,0,1,0|2,0,0]=4 2101 B9R1.12 CCNCc1c[nH]cn1 2230a_100015525214_100000707719 [0,1,0,0,1,0|1,0,1]=4 2102 B9R1.12 CCNCc1cc[nH]n1 207a_100015525214_100000738523 [0,1,0,0,1,0|2,0,0]=4 2103 B9R1.12 CCNCc1cc[nH]n1 270004a_100015525214_100000738523 [0,1,0,0,1,0|2,0,0]=4 2104 B9R1.12 CCNCc1ccco1 207a_100015525214_100000186105 [0,1,0,0,1,0|2,0,0]=4 2105 B9R1.12 CCNCc1ccco1 2230a_100000185738_100000210202 [0,1,0,0,1,0|2,0,0]=4 2106 B9R1.12 CCNCc1ccco1 270004a_100015525214_100000186105 [0,1,0,0,1,0|2,0,0]=4 2107 B9R1.12 CCNCc1ccco1 34a_100000185738_100000210202 [0,1,0,0,1,0|2,0,0]=4 2108 B9R1.12 CCNCc1cccs1 207a_100015525214_100000209959 [0,1,0,0,1,0|2,0,0]=4 2109 B9R1.12 CCNCc1cccs1 2230a_100000211653_100000210202 [0,1,0,0,1,0|2,0,0]=4 2110 B9R1.12 CCNCc1cccs1 270004a_100015525214_100000209959 [0,1,0,0,1,0|2,0,0]=4 2111 B9R1.12 CCNCc1ccn[nH]1 2230a_100015525214_100000728653 [0,1,0,0,1,0|2,0,0]=4 2112 B9R1.12 CCNCc1ccoc1 207a_100015525214_100011215517 [0,1,0,0,1,0|2,0,0]=4 2113 B9R1.12 CCNCc1ccoc1 2230a_100015206860_100000210202 [0,1,0,0,1,0|2,0,0]=4 2114 B9R1.12 CCNCc1ccoc1 270004a_100015525214_100011215517 [0,1,0,0,1,0|2,0,0]=4 2115 B9R1.12 CCNCc1ccoc1 34a_100015206860_100000210202 [0,1,0,0,1,0|2,0,0]=4 2116 B9R1.12 CCNCc1ccon1 2230a_100015525214_100000234950 [0,1,0,0,1,0|2,0,0]=4 2117 B9R1.12 CCNCc1ccsc1 207a_100015525214_100000188534 [0,1,0,0,1,0|2,0,0]=4 2118 B9R1.12 CCNCc1ccsc1 2230a_100000186416_100000210202 [0,1,0,0,1,0|2,0,0]=4 2119 B9R1.12 CCNCc1ccsc1 2230a_100015525214_100011261437 [0,1,0,0,1,0|2,0,0]=4 2120 B9R1.12 CCNCc1ccsc1 270004a_100015525214_100000188534 [0,1,0,0,1,0|2,0,0]=4 2121 B9R1.12 CCNCc1ccsc1 34a_100000186416_100000210202 [0,1,0,0,1,0|2,0,0]=4 2122 B9R1.12 CCNCc1cn[nH]c1 207a_100015525214_100016992096 [0,1,0,0,1,0|2,0,0]=4 2123 B9R1.12 CCNCc1cn[nH]c1 270004a_100015525214_100016992096 [0,1,0,0,1,0|2,0,0]=4 2124 B9R1.12 CCNCc1cnc[nH]1 207a_100015525214_100000742939 [0,1,0,0,1,0|1,0,1]=4 2125 B9R1.12 CCNCc1cnco1 270004a_100015525214_100000064291 [0,1,0,0,1,0|2,0,0]=4 2126 B9R1.12 CCNCc1cncs1 207a_100015525214_100000749870 [0,1,0,0,1,0|2,0,0]=4 2127 B9R1.12 CCNCc1cncs1 2230a_100015525214_100015185245 [0,1,0,0,1,0|2,0,0]=4 2128 B9R1.12 CCNCc1cncs1 2230a_100016987365_100000210202 [0,1,0,0,1,0|2,0,0]=4 2129 B9R1.12 CCNCc1cncs1 270004a_100015525214_100000749870 [0,1,0,0,1,0|2,0,0]=4 2130 B9R1.12 CCNCc1cocn1 270004a_100015525214_100000050382 [0,1,0,0,1,0|2,0,0]=4 2131 B9R1.12 CCNCc1cscn1 207a_100015525214_100000743575 [0,1,0,0,1,0|2,0,0]=4 2132 B9R1.12 CCNCc1cscn1 2230a_100015185402_100000210202 [0,1,0,0,1,0|2,0,0]=4 2133 B9R1.12 CCNCc1cscn1 2230a_100015525214_100000205941 [0,1,0,0,1,0|2,0,0]=4 2134 B9R1.12 CCNCc1cscn1 270004a_100015525214_100000743575 [0,1,0,0,1,0|2,0,0]=4 2135 B9R1.12 CCNCc1ncc[nH]1 207a_100015525214_100000743867 [0,1,0,0,1,0|1,0,1]=4 2136 B9R1.12 CCNCc1ncc[nH]1 2230a_100015525214_100016991755 [0,1,0,0,1,0|1,0,1]=4 2137 B9R1.12 CCNCc1ncco1 2230a_100015525214_103436540062 [0,1,0,0,1,0|2,0,0]=4 2138 B9R1.12 CCNCc1ncco1 2230a_100016994969_100000210202 [0,1,0,0,1,0|2,0,0]=4 2139 B9R1.12 CCNCc1ncco1 270004a_100015525214_100000064290 [0,1,0,0,1,0|2,0,0]=4 2140 B9R1.12 CCNCc1nccs1 207a_100015525214_100000750902 [0,1,0,0,1,0|2,0,0]=4 2141 B9R1.12 CCNCc1nccs1 2230a_100000740555_100000210202 [0,1,0,0,1,0|2,0,0]=4 2142 B9R1.12 CCNCc1nccs1 2230a_100015525214_100015184050 [0,1,0,0,1,0|2,0,0]=4 2143 B9R1.12 CCNCc1nccs1 270004a_100015525214_100000750902 [0,1,0,0,1,0|2,0,0]=4 2144 B9R1.12 CCNCn1cncn1 2230a_100015525214_200020645497 [0,1,0,0,1,0|2,0,0]=4 2145 B9R1.12 CCOCc1c[nH]cn1 34a_100121572206_100000707719 [0,1,0,0,1,0|1,0,1]=4 2146 B9R1.12 CCOCc1ccco1 34a_100000210059_100000210202 [0,1,0,0,1,0|2,0,0]=4 2147 B9R1.12 CCOCc1cccs1 34a_100000211240_100000210202 [0,1,0,0,1,0|2,0,0]=4 2148 B9R1.12 CCOCc1ccn[nH]1 34a_100121572206_100000728653 [0,1,0,0,1,0|2,0,0]=4 2149 B9R1.12 CCOCc1ccno1 34a_100000740478_100000210202 [0,1,0,0,1,0|2,0,0]=4 2150 B9R1.12 CCOCc1ccoc1 34a_100011215357_100000210202 [0,1,0,0,1,0|2,0,0]=4 2151 B9R1.12 CCOCc1ccon1 34a_100121572206_100000234950 [0,1,0,0,1,0|2,0,0]=4 2152 B9R1.12 CCOCc1ccsc1 34a_100011215551_100000210202 [0,1,0,0,1,0|2,0,0]=4 2153 B9R1.12 CCOCc1ccsc1 34a_100121572206_100011261437 [0,1,0,0,1,0|2,0,0]=4 2154 B9R1.12 CCOCc1cncs1 34a_100121572206_100015185245 [0,1,0,0,1,0|2,0,0]=4 2155 B9R1.12 CCOCc1cscn1 34a_100121572206_100000205941 [0,1,0,0,1,0|2,0,0]=4 2156 B9R1.12 CCOCc1ncc[nH]1 34a_100121572206_100016991755 [0,1,0,0,1,0|1,0,1]=4 2157 B9R1.12 CCOCc1ncco1 34a_100000062594_100000210202 [0,1,0,0,1,0|2,0,0]=4 2158 B9R1.12 CCOCc1ncco1 34a_100121572206_103436540062 [0,1,0,0,1,0|2,0,0]=4 2159 B9R1.12 CCOCc1nccs1 34a_100121572206_100015184050 [0,1,0,0,1,0|2,0,0]=4 2160 B9R1.12 CCOCc1ncon1 34a_100121572206_100000233494 [0,1,0,0,1,0|2,0,0]=4 2161 B9R1.12 CCOCn1cccn1 34a_100000731028_100000210202 [0,1,0,0,1,0|2,0,0]=4 2162 B9R1.12 CCOCn1cncn1 34a_100121572206_200020645497 [0,1,0,0,1,0|2,0,0]=4 2163 B9R1.12 CCSCc1c[nH]cn1 62a_100000210202_100000707719 [0,1,0,0,1,0|1,0,1]=4 2164 B9R1.12 CCSCc1c[nH]cn1 62a_100000707719_100000210202 [0,1,0,0,1,0|1,0,1]=4 2165 B9R1.12 CCSCc1ccn[nH]1 62a_100000210202_100000728653 [0,1,0,0,1,0|2,0,0]=4 2166 B9R1.12 CCSCc1ccn[nH]1 62a_100000728653_100000210202 [0,1,0,0,1,0|2,0,0]=4 2167 B9R1.12 CCSCc1ccon1 62a_100000210202_100000234950 [0,1,0,0,1,0|2,0,0]=4 2168 B9R1.12 CCSCc1ccon1 62a_100000234950_100000210202 [0,1,0,0,1,0|2,0,0]=4 2169 B9R1.12 CCSCc1ccsc1 62a_100000210202_100011233845 [0,1,0,0,1,0|2,0,0]=4 2170 B9R1.12 CCSCc1ccsc1 62a_100011261437_100000210202 [0,1,0,0,1,0|2,0,0]=4 2171 B9R1.12 CCSCc1cncs1 62a_100000210202_100015185245 [0,1,0,0,1,0|2,0,0]=4 2172 B9R1.12 CCSCc1cncs1 62a_100015185245_100000210202 [0,1,0,0,1,0|2,0,0]=4 2173 B9R1.12 CCSCc1cscn1 62a_100000205941_100000210202 [0,1,0,0,1,0|2,0,0]=4 2174 B9R1.12 CCSCc1cscn1 62a_100000210202_100000205941 [0,1,0,0,1,0|2,0,0]=4 2175 B9R1.12 CCSCc1ncc[nH]1 62a_100000210202_100016991755 [0,1,0,0,1,0|1,0,1]=4 2176 B9R1.12 CCSCc1ncc[nH]1 62a_100016991755_100000210202 [0,1,0,0,1,0|1,0,1]=4 2177 B9R1.12 CCSCc1ncco1 62a_100000210202_103436540062 [0,1,0,0,1,0|2,0,0]=4 2178 B9R1.12 CCSCc1ncco1 62a_103436540062_100000210202 [0,1,0,0,1,0|2,0,0]=4 2179 B9R1.12 CCSCc1nccs1 62a_100000210202_100015184050 [0,1,0,0,1,0|2,0,0]=4 2180 B9R1.12 CCSCc1nccs1 62a_100015184050_100000210202 [0,1,0,0,1,0|2,0,0]=4 2181 B9R1.12 CCSCc1ncon1 62a_100000210202_100000233494 [0,1,0,0,1,0|2,0,0]=4 2182 B9R1.12 CCSCc1ncon1 62a_100000233494_100000210202 [0,1,0,0,1,0|2,0,0]=4 2183 B9R1.12 CCSCn1cncn1 62a_100000210202_200020645497 [0,1,0,0,1,0|2,0,0]=4 2184 B9R1.12 CCSCn1cncn1 62a_200020645497_100000210202 [0,1,0,0,1,0|2,0,0]=4 2185 B9R1.12 CNCCc1c[nH]cn1 2230a_106832991635_100020628418 [0,1,0,0,1,0|1,0,1]=4 2186 B9R1.12 CNCCc1c[nH]cn1 7a_106832991635_100020628418 [0,1,0,0,1,0|1,0,1]=4 2187 B9R1.12 CNCCc1ccco1 2230a_100000694680_200000210301 [0,1,0,0,1,0|2,0,0]=4 2188 B9R1.12 CNCCc1ccco1 34a_100000694680_200000210301 [0,1,0,0,1,0|2,0,0]=4 2189 B9R1.12 CNCCc1cccs1 2230a_100000203755_200000210301 [0,1,0,0,1,0|2,0,0]=4 2190 B9R1.12 CNCCc1cccs1 2230a_106832991635_100000748579 [0,1,0,0,1,0|2,0,0]=4 2191 B9R1.12 CNCCc1cccs1 34a_100000203755_200000210301 [0,1,0,0,1,0|2,0,0]=4 2192 B9R1.12 CNCCc1cccs1 34a_100102657272_100000748579 [0,1,0,0,1,0|2,0,0]=4 2193 B9R1.12 CNCCc1cccs1 7a_106832991635_100000748579 [0,1,0,0,1,0|2,0,0]=4 2194 B9R1.12 CNCCc1ccsc1 2230a_100000692642_200000210301 [0,1,0,0,1,0|2,0,0]=4 2195 B9R1.12 CNCCc1ccsc1 34a_100000692642_200000210301 [0,1,0,0,1,0|2,0,0]=4 2196 B9R1.12 CNCCc1cn[nH]c1 2230a_100000732747_200000210301 [0,1,0,0,1,0|2,0,0]=4 2197 B9R1.12 CNCCc1cn[nH]c1 2230a_106832991635_100000743252 [0,1,0,0,1,0|2,0,0]=4 2198 B9R1.12 CNCCc1cn[nH]c1 7a_106832991635_100000743252 [0,1,0,0,1,0|2,0,0]=4 2199 B9R1.12 CNCCc1cncs1 2230a_100016991637_200000210301 [0,1,0,0,1,0|2,0,0]=4 2200 B9R1.12 CNCCc1nccs1 2230a_100015186391_200000210301 [0,1,0,0,1,0|2,0,0]=4 2201 B9R1.12 CNCCn1cccn1 2230a_100011200920_200000210301 [0,1,0,0,1,0|2,0,0]=4 2202 B9R1.12 CNCCn1cccn1 2230a_106832991635_100000685285 [0,1,0,0,1,0|2,0,0]=4 2203 B9R1.12 CNCCn1cccn1 34a_100102657272_100015204718 [0,1,0,0,1,0|2,0,0]=4 2204 B9R1.12 CNCCn1cccn1 7a_106832991635_100000685285 [0,1,0,0,1,0|2,0,0]=4 2205 B9R1.12 CNCCn1ccnc1 7a_106832991635_100000702546 [0,1,0,0,1,0|2,0,0]=4 2206 B9R1.12 CNCCn1cncn1 2230a_106832991635_100000731791 [0,1,0,0,1,0|2,0,0]=4 2207 B9R1.12 CNCCn1cncn1 2230a_200000738561_200000210301 [0,1,0,0,1,0|2,0,0]=4 2208 B9R1.12 CNCCn1cncn1 34a_100102657272_200000749826 [0,1,0,0,1,0|2,0,0]=4 2209 B9R1.12 CNCCn1cncn1 7a_106832991635_100000731791 [0,1,0,0,1,0|2,0,0]=4 2210 B9R1.12 COCCc1cccs1 34a_100011216825_200000210301 [0,1,0,0,1,0|1,1,0]=4 2211 B9R1.12 COCCc1cccs1 34a_100138415774_100000748579 [0,1,0,0,1,0|1,1,0]=4 2212 B9R1.12 COCCc1cccs1 7a_100011216825_200000210301 [0,1,0,0,1,0|1,1,0]=4 2213 B9R1.12 COCCc1ccsc1 34a_100000748821_200000210301 [0,1,0,0,1,0|1,1,0]=4 2214 B9R1.12 COCCc1cn[nH]c1 34a_100000766553_200000210301 [0,1,0,0,1,0|1,1,0]=4 2215 B9R1.12 COCCc1cnoc1 34a_100000732699_200000210301 [0,1,0,0,1,0|1,1,0]=4 2216 B9R1.12 COCCc1ncc[nH]1 34a_103549771195_200000210301 [0,1,0,0,1,0|0,1,1]=4 2217 B9R1.12 COCCn1cccn1 34a_100000743371_200000210301 [0,1,0,0,1,0|1,1,0]=4 2218 B9R1.12 COCCn1cccn1 34a_100138415774_100015204718 [0,1,0,0,1,0|1,1,0]=4 2219 B9R1.12 COCCn1ccnc1 34a_100000719764_200000210301 [0,1,0,0,1,0|1,1,0]=4 2220 B9R1.12 COCCn1cncn1 34a_100000745309_200000210301 [0,1,0,0,1,0|1,1,0]=4 2221 B9R1.12 COCCn1cncn1 34a_100138415774_200000749826 [0,1,0,0,1,0|1,1,0]=4 2222 B9R1.12 CSCCc1c[nH]cn1 62a_100020628418_200000210301 [0,1,0,0,1,0|0,0,1]=3 2223 B9R1.12 CSCCc1c[nH]cn1 62a_200000210301_100020628418 [0,1,0,0,1,0|0,0,1]=3 2224 B9R1.12 CSCCc1cccs1 62a_100000748579_200000210301 [0,1,0,0,1,0|1,0,0]=3 2225 B9R1.12 CSCCc1cccs1 62a_200000210301_100000748579 [0,1,0,0,1,0|1,0,0]=3 2226 B9R1.12 CSCCc1cn[nH]c1 62a_100000743252_200000210301 [0,1,0,0,1,0|1,0,0]=3 2227 B9R1.12 CSCCc1cn[nH]c1 62a_200000210301_100000743252 [0,1,0,0,1,0|1,0,0]=3 2228 B9R1.12 CSCCc1nnn[nH]1 62a_100000031946_200000210301 [0,1,0,0,1,0|2,0,0]=4 2229 B9R1.12 CSCCc1nnn[nH]1 62a_200000210301_100000031946 [0,1,0,0,1,0|2,0,0]=4 2230 B9R1.12 CSCCn1cccc1 62a_200000210301_200000035178 [0,1,0,0,1,0|2,0,0]=4 2231 B9R1.12 CSCCn1cccc1 62a_200009811947_200000210301 [0,1,0,0,1,0|2,0,0]=4 2232 B9R1.12 CSCCn1cccn1 62a_100015204718_200000210301 [0,1,0,0,1,0|1,0,0]=3 2233 B9R1.12 CSCCn1cccn1 62a_200000210301_100000685285 [0,1,0,0,1,0|1,0,0]=3 2234 B9R1.12 CSCCn1ccnc1 62a_100000702546_200000210301 [0,1,0,0,1,0|1,0,0]=3 2235 B9R1.12 CSCCn1ccnc1 62a_200000210301_100000702546 [0,1,0,0,1,0|1,0,0]=3 2236 B9R1.12 CSCCn1cncn1 62a_100000731791_200000210301 [0,1,0,0,1,0|1,0,0]=3 2237 B9R1.12 CSCCn1cncn1 62a_200000210301_100000731791 [0,1,0,0,1,0|1,0,0]=3 2238 B9R1.12 CSCOc1ccsc1 34a_100000106738_100011218213 [0,1,0,0,1,0|2,0,0]=4 2239 B9R1.12 CSCSc1c[nH]cn1 62a_100000756875_100011218213 [0,1,0,0,1,0|1,0,1]=4 2240 B9R1.12 CSCSc1c[nH]cn1 62a_100011218213_100000756875 [0,1,0,0,1,0|1,0,1]=4 2241 B9R1.12 CSCSc1cc[nH]n1 62a_100000062575_100011218213 [0,1,0,0,1,0|2,0,0]=4 2242 B9R1.12 CSCSc1cc[nH]n1 62a_100011218213_100000062575 [0,1,0,0,1,0|2,0,0]=4 2243 B9R1.12 CSCSc1ccco1 62a_100009814098_100011218213 [0,1,0,0,1,0|2,0,0]=4 2244 B9R1.12 CSCSc1ccco1 62a_100011218213_100009814098 [0,1,0,0,1,0|2,0,0]=4 2245 B9R1.12 CSCSc1cccs1 62a_100011215356_100011218213 [0,1,0,0,1,0|2,0,0]=4 2246 B9R1.12 CSCSc1cccs1 62a_100011218213_100011215356 [0,1,0,0,1,0|2,0,0]=4 2247 B9R1.12 CSCSc1ccoc1 62a_100011215275_100011218213 [0,1,0,0,1,0|2,0,0]=4 2248 B9R1.12 CSCSc1ccoc1 62a_100011218213_100011215275 [0,1,0,0,1,0|2,0,0]=4 2249 B9R1.12 CSCSc1ccon1 62a_100009818083_100011218213 [0,1,0,0,1,0|2,0,0]=4 2250 B9R1.12 CSCSc1ccon1 62a_100011218213_100009818083 [0,1,0,0,1,0|2,0,0]=4 2251 B9R1.12 CSCSc1ccsc1 62a_100000738268_100011218213 [0,1,0,0,1,0|2,0,0]=4 2252 B9R1.12 CSCSc1ccsc1 62a_100011218213_100000738268 [0,1,0,0,1,0|2,0,0]=4 2253 B9R1.12 CSCSc1ccsn1 62a_100009818082_100011218213 [0,1,0,0,1,0|2,0,0]=4 2254 B9R1.12 CSCSc1ccsn1 62a_100011218213_100009818082 [0,1,0,0,1,0|2,0,0]=4 2255 B9R1.12 CSCSc1cn[nH]c1 62a_100000238712_100011218213 [0,1,0,0,1,0|2,0,0]=4 2256 B9R1.12 CSCSc1cn[nH]c1 62a_100011218213_100000238712 [0,1,0,0,1,0|2,0,0]=4 2257 B9R1.12 CSCSc1cnco1 62a_100011218213_100020591547 [0,1,0,0,1,0|2,0,0]=4 2258 B9R1.12 CSCSc1cnco1 62a_100020591547_100011218213 [0,1,0,0,1,0|2,0,0]=4 2259 B9R1.12 CSCSc1cncs1 62a_100011218213_100011934649 [0,1,0,0,1,0|2,0,0]=4 2260 B9R1.12 CSCSc1cncs1 62a_100011934649_100011218213 [0,1,0,0,1,0|2,0,0]=4 2261 B9R1.12 CSCSc1cnoc1 62a_100009815712_100011218213 [0,1,0,0,1,0|2,0,0]=4 2262 B9R1.12 CSCSc1cnoc1 62a_100011218213_100009815712 [0,1,0,0,1,0|2,0,0]=4 2263 B9R1.12 CSCSc1cnsc1 62a_100009815736_100011218213 [0,1,0,0,1,0|2,0,0]=4 2264 B9R1.12 CSCSc1cnsc1 62a_100011218213_100009815736 [0,1,0,0,1,0|2,0,0]=4 2265 B9R1.12 CSCSc1cscn1 62a_100000751502_100011218213 [0,1,0,0,1,0|2,0,0]=4 2266 B9R1.12 CSCSc1cscn1 62a_100011218213_100000751502 [0,1,0,0,1,0|2,0,0]=4 2267 B9R1.12 CSCSc1nc[nH]n1 62a_100000761765_100011218213 [0,1,0,0,1,0|2,0,0]=4 2268 B9R1.12 CSCSc1nc[nH]n1 62a_100011218213_100000761765 [0,1,0,0,1,0|2,0,0]=4 2269 B9R1.12 CSCSc1ncc[nH]1 62a_100011218213_100025796157 [0,1,0,0,1,0|1,0,1]=4 2270 B9R1.12 CSCSc1ncc[nH]1 62a_100025796157_100011218213 [0,1,0,0,1,0|1,0,1]=4 2271 B9R1.12 CSCSc1ncco1 62a_100011218213_100011787736 [0,1,0,0,1,0|2,0,0]=4 2272 B9R1.12 CSCSc1ncco1 62a_100011787736_100011218213 [0,1,0,0,1,0|2,0,0]=4 2273 B9R1.12 CSCSc1nccs1 62a_100000211983_100011218213 [0,1,0,0,1,0|2,0,0]=4 2274 B9R1.12 CSCSc1nccs1 62a_100011218213_100000211983 [0,1,0,0,1,0|2,0,0]=4 2275 B9R1.12 CSCSc1ncns1 62a_100000693119_100011218213 [0,1,0,0,1,0|2,0,0]=4 2276 B9R1.12 CSCSc1ncns1 62a_100011218213_100000693119 [0,1,0,0,1,0|2,0,0]=4 2277 B9R1.12 FCCOc1ccsc1 34a_100000106738_100011217306 [0,1,0,0,1,0|2,0,0]=4 2278 B9R1.12 FCCOc1ccsc1 7a_100000106738_100011217306 [0,1,0,0,1,0|2,0,0]=4 2279 B9R1.12 FCCSc1c[nH]cn1 62a_100000756875_100011217306 [0,1,0,0,1,0|1,0,1]=4 2280 B9R1.12 FCCSc1c[nH]cn1 62a_100011217306_100000756875 [0,1,0,0,1,0|1,0,1]=4 2281 B9R1.12 FCCSc1cc[nH]n1 62a_100000062575_100011217306 [0,1,0,0,1,0|2,0,0]=4 2282 B9R1.12 FCCSc1cc[nH]n1 62a_100011217306_100000062575 [0,1,0,0,1,0|2,0,0]=4 2283 B9R1.12 FCCSc1ccco1 62a_100009814098_100011217306 [0,1,0,0,1,0|2,0,0]=4 2284 B9R1.12 FCCSc1ccco1 62a_100011217306_100009814098 [0,1,0,0,1,0|2,0,0]=4 2285 B9R1.12 FCCSc1cccs1 62a_100011215356_100011217306 [0,1,0,0,1,0|2,0,0]=4 2286 B9R1.12 FCCSc1cccs1 62a_100011217306_100011215356 [0,1,0,0,1,0|2,0,0]=4 2287 B9R1.12 FCCSc1ccoc1 62a_100011215275_100011217306 [0,1,0,0,1,0|2,0,0]=4 2288 B9R1.12 FCCSc1ccoc1 62a_100011217306_100011215275 [0,1,0,0,1,0|2,0,0]=4 2289 B9R1.12 FCCSc1ccon1 62a_100009818083_100011217306 [0,1,0,0,1,0|2,0,0]=4 2290 B9R1.12 FCCSc1ccon1 62a_100011217306_100009818083 [0,1,0,0,1,0|2,0,0]=4 2291 B9R1.12 FCCSc1ccsc1 62a_100000738268_100011217306 [0,1,0,0,1,0|2,0,0]=4 2292 B9R1.12 FCCSc1ccsc1 62a_100011217306_100000738268 [0,1,0,0,1,0|2,0,0]=4 2293 B9R1.12 FCCSc1ccsn1 62a_100009818082_100011217306 [0,1,0,0,1,0|2,0,0]=4 2294 B9R1.12 FCCSc1ccsn1 62a_100011217306_100009818082 [0,1,0,0,1,0|2,0,0]=4 2295 B9R1.12 FCCSc1cn[nH]c1 62a_100000238712_100011217306 [0,1,0,0,1,0|2,0,0]=4 2296 B9R1.12 FCCSc1cn[nH]c1 62a_100011217306_100000238712 [0,1,0,0,1,0|2,0,0]=4 2297 B9R1.12 FCCSc1cnco1 62a_100011217306_100020591547 [0,1,0,0,1,0|2,0,0]=4 2298 B9R1.12 FCCSc1cnco1 62a_100020591547_100011217306 [0,1,0,0,1,0|2,0,0]=4 2299 B9R1.12 FCCSc1cncs1 62a_100011217306_100011934649 [0,1,0,0,1,0|2,0,0]=4 2300 B9R1.12 FCCSc1cncs1 62a_100011934649_100011217306 [0,1,0,0,1,0|2,0,0]=4 2301 B9R1.12 FCCSc1cnoc1 62a_100009815712_100011217306 [0,1,0,0,1,0|2,0,0]=4 2302 B9R1.12 FCCSc1cnoc1 62a_100011217306_100009815712 [0,1,0,0,1,0|2,0,0]=4 2303 B9R1.12 FCCSc1cnsc1 62a_100009815736_100011217306 [0,1,0,0,1,0|2,0,0]=4 2304 B9R1.12 FCCSc1cnsc1 62a_100011217306_100009815736 [0,1,0,0,1,0|2,0,0]=4 2305 B9R1.12 FCCSc1cscn1 62a_100000751502_100011217306 [0,1,0,0,1,0|2,0,0]=4 2306 B9R1.12 FCCSc1cscn1 62a_100011217306_100000751502 [0,1,0,0,1,0|2,0,0]=4 2307 B9R1.12 FCCSc1nc[nH]n1 62a_100000761765_100011217306 [0,1,0,0,1,0|2,0,0]=4 2308 B9R1.12 FCCSc1nc[nH]n1 62a_100011217306_100000761765 [0,1,0,0,1,0|2,0,0]=4 2309 B9R1.12 FCCSc1ncc[nH]1 62a_100011217306_100025796157 [0,1,0,0,1,0|1,0,1]=4 2310 B9R1.12 FCCSc1ncc[nH]1 62a_100025796157_100011217306 [0,1,0,0,1,0|1,0,1]=4 2311 B9R1.12 FCCSc1ncco1 62a_100011217306_100011787736 [0,1,0,0,1,0|2,0,0]=4 2312 B9R1.12 FCCSc1ncco1 62a_100011787736_100011217306 [0,1,0,0,1,0|2,0,0]=4 2313 B9R1.12 FCCSc1nccs1 62a_100000211983_100011217306 [0,1,0,0,1,0|2,0,0]=4 2314 B9R1.12 FCCSc1nccs1 62a_100011217306_100000211983 [0,1,0,0,1,0|2,0,0]=4 2315 B9R1.12 FCCSc1ncns1 62a_100000693119_100011217306 [0,1,0,0,1,0|2,0,0]=4 2316 B9R1.12 FCCSc1ncns1 62a_100011217306_100000693119 [0,1,0,0,1,0|2,0,0]=4 2317 B9R1.12 FCNCc1ccco1 34a_100000185738_100015361967 [0,1,0,0,1,0|2,0,0]=4 2318 B9R1.12 FCNCc1ccoc1 34a_100015206860_100015361967 [0,1,0,0,1,0|2,0,0]=4 2319 B9R1.12 FCNCc1ccsc1 34a_100000186416_100015361967 [0,1,0,0,1,0|2,0,0]=4 2320 B9R1.12 FCOCc1ccco1 34a_100000210059_100015361967 [0,1,0,0,1,0|2,0,0]=4 2321 B9R1.12 FCOCc1cccs1 34a_100000211240_100015361967 [0,1,0,0,1,0|2,0,0]=4 2322 B9R1.12 FCOCc1ccno1 34a_100000740478_100015361967 [0,1,0,0,1,0|2,0,0]=4 2323 B9R1.12 FCOCc1ccoc1 34a_100011215357_100015361967 [0,1,0,0,1,0|2,0,0]=4 2324 B9R1.12 FCOCc1ccsc1 34a_100011215551_100015361967 [0,1,0,0,1,0|2,0,0]=4 2325 B9R1.12 FCOCc1ncco1 34a_100000062594_100015361967 [0,1,0,0,1,0|2,0,0]=4 2326 B9R1.12 FCOCn1cccn1 34a_100000731028_100015361967 [0,1,0,0,1,0|2,0,0]=4 2327 B9R1.12 FCSCc1c[nH]cn1 62a_100000707719_100015361967 [0,1,0,0,1,0|1,0,1]=4 2328 B9R1.12 FCSCc1c[nH]cn1 62a_100015361967_100000707719 [0,1,0,0,1,0|1,0,1]=4 2329 B9R1.12 FCSCc1ccn[nH]1 62a_100000728653_100015361967 [0,1,0,0,1,0|2,0,0]=4 2330 B9R1.12 FCSCc1ccn[nH]1 62a_100015361967_100000728653 [0,1,0,0,1,0|2,0,0]=4 2331 B9R1.12 FCSCc1ccon1 62a_100000234950_100015361967 [0,1,0,0,1,0|2,0,0]=4 2332 B9R1.12 FCSCc1ccon1 62a_100015361967_100000234950 [0,1,0,0,1,0|2,0,0]=4 2333 B9R1.12 FCSCc1ccsc1 62a_100011261437_100015361967 [0,1,0,0,1,0|2,0,0]=4 2334 B9R1.12 FCSCc1ccsc1 62a_100015361967_100011233845 [0,1,0,0,1,0|2,0,0]=4 2335 B9R1.12 FCSCc1cncs1 62a_100015185245_100015361967 [0,1,0,0,1,0|2,0,0]=4 2336 B9R1.12 FCSCc1cncs1 62a_100015361967_100015185245 [0,1,0,0,1,0|2,0,0]=4 2337 B9R1.12 FCSCc1cscn1 62a_100000205941_100015361967 [0,1,0,0,1,0|2,0,0]=4 2338 B9R1.12 FCSCc1cscn1 62a_100015361967_100000205941 [0,1,0,0,1,0|2,0,0]=4 2339 B9R1.12 FCSCc1ncc[nH]1 62a_100015361967_100016991755 [0,1,0,0,1,0|1,0,1]=4 2340 B9R1.12 FCSCc1ncc[nH]1 62a_100016991755_100015361967 [0,1,0,0,1,0|1,0,1]=4 2341 B9R1.12 FCSCc1ncco1 62a_100015361967_103436540062 [0,1,0,0,1,0|2,0,0]=4 2342 B9R1.12 FCSCc1ncco1 62a_103436540062_100015361967 [0,1,0,0,1,0|2,0,0]=4 2343 B9R1.12 FCSCc1nccs1 62a_100015184050_100015361967 [0,1,0,0,1,0|2,0,0]=4 2344 B9R1.12 FCSCc1nccs1 62a_100015361967_100015184050 [0,1,0,0,1,0|2,0,0]=4 2345 B9R1.12 FCSCc1ncon1 62a_100000233494_100015361967 [0,1,0,0,1,0|2,0,0]=4 2346 B9R1.12 FCSCc1ncon1 62a_100015361967_100000233494 [0,1,0,0,1,0|2,0,0]=4 2347 B9R1.12 FCSCn1cncn1 62a_100015361967_200020645497 [0,1,0,0,1,0|2,0,0]=4 2348 B9R1.12 FCSCn1cncn1 62a_200020645497_100015361967 [0,1,0,0,1,0|2,0,0]=4 2349 B9R1.12 OCCNc1ncns1 27a_100000210304_100000693119 [0,1,0,0,1,0|1,1,0]=4 2350 B9R1.12 OCCOc1ccsc1 34a_100000106738_100000211926 [0,1,0,0,1,0|1,1,0]=4 2351 B9R1.12 OCCOc1ccsc1 7a_100000106738_100000211926 [0,1,0,0,1,0|1,1,0]=4 2352 B9R1.12 OCCSc1c[nH]cn1 62a_100000211926_100000756875 [0,1,0,0,1,0|0,1,1]=4 2353 B9R1.12 OCCSc1c[nH]cn1 62a_100000756875_100000211926 [0,1,0,0,1,0|0,1,1]=4 2354 B9R1.12 OCCSc1cc[nH]n1 62a_100000062575_100000211926 [0,1,0,0,1,0|1,1,0]=4 2355 B9R1.12 OCCSc1cc[nH]n1 62a_100000211926_100000062575 [0,1,0,0,1,0|1,1,0]=4 2356 B9R1.12 OCCSc1ccco1 62a_100000211926_100009814098 [0,1,0,0,1,0|1,1,0]=4 2357 B9R1.12 OCCSc1ccco1 62a_100009814098_100000211926 [0,1,0,0,1,0|1,1,0]=4 2358 B9R1.12 OCCSc1cccs1 62a_100000211926_100011215356 [0,1,0,0,1,0|1,1,0]=4 2359 B9R1.12 OCCSc1cccs1 62a_100011215356_100000211926 [0,1,0,0,1,0|1,1,0]=4 2360 B9R1.12 OCCSc1ccoc1 62a_100000211926_100011215275 [0,1,0,0,1,0|1,1,0]=4 2361 B9R1.12 OCCSc1ccoc1 62a_100011215275_100000211926 [0,1,0,0,1,0|1,1,0]=4 2362 B9R1.12 OCCSc1ccon1 62a_100000211926_100009818083 [0,1,0,0,1,0|1,1,0]=4 2363 B9R1.12 OCCSc1ccon1 62a_100009818083_100000211926 [0,1,0,0,1,0|1,1,0]=4 2364 B9R1.12 OCCSc1ccsc1 62a_100000211926_100000738268 [0,1,0,0,1,0|1,1,0]=4 2365 B9R1.12 OCCSc1ccsc1 62a_100000738268_100000211926 [0,1,0,0,1,0|1,1,0]=4 2366 B9R1.12 OCCSc1ccsn1 62a_100000211926_100009818082 [0,1,0,0,1,0|1,1,0]=4 2367 B9R1.12 OCCSc1ccsn1 62a_100009818082_100000211926 [0,1,0,0,1,0|1,1,0]=4 2368 B9R1.12 OCCSc1cn[nH]c1 62a_100000211926_100000238712 [0,1,0,0,1,0|1,1,0]=4 2369 B9R1.12 OCCSc1cn[nH]c1 62a_100000238712_100000211926 [0,1,0,0,1,0|1,1,0]=4 2370 B9R1.12 OCCSc1cnco1 62a_100000211926_100020591547 [0,1,0,0,1,0|1,1,0]=4 2371 B9R1.12 OCCSc1cnco1 62a_100020591547_100000211926 [0,1,0,0,1,0|1,1,0]=4 2372 B9R1.12 OCCSc1cncs1 62a_100000211926_100011934649 [0,1,0,0,1,0|1,1,0]=4 2373 B9R1.12 OCCSc1cncs1 62a_100011934649_100000211926 [0,1,0,0,1,0|1,1,0]=4 2374 B9R1.12 OCCSc1cnoc1 62a_100000211926_100009815712 [0,1,0,0,1,0|1,1,0]=4 2375 B9R1.12 OCCSc1cnoc1 62a_100009815712_100000211926 [0,1,0,0,1,0|1,1,0]=4 2376 B9R1.12 OCCSc1cnsc1 62a_100000211926_100009815736 [0,1,0,0,1,0|1,1,0]=4 2377 B9R1.12 OCCSc1cnsc1 62a_100009815736_100000211926 [0,1,0,0,1,0|1,1,0]=4 2378 B9R1.12 OCCSc1cscn1 62a_100000211926_100000751502 [0,1,0,0,1,0|1,1,0]=4 2379 B9R1.12 OCCSc1cscn1 62a_100000751502_100000211926 [0,1,0,0,1,0|1,1,0]=4 2380 B9R1.12 OCCSc1nc[nH]n1 62a_100000211926_100000761765 [0,1,0,0,1,0|1,1,0]=4 2381 B9R1.12 OCCSc1nc[nH]n1 62a_100000761765_100000211926 [0,1,0,0,1,0|1,1,0]=4 2382 B9R1.12 OCCSc1ncc[nH]1 62a_100000211926_100025796157 [0,1,0,0,1,0|0,1,1]=4 2383 B9R1.12 OCCSc1ncc[nH]1 62a_100025796157_100000211926 [0,1,0,0,1,0|0,1,1]=4 2384 B9R1.12 OCCSc1ncco1 62a_100000211926_100011787736 [0,1,0,0,1,0|1,1,0]=4 2385 B9R1.12 OCCSc1ncco1 62a_100011787736_100000211926 [0,1,0,0,1,0|1,1,0]=4 2386 B9R1.12 OCCSc1nccs1 62a_100000211926_100000211983 [0,1,0,0,1,0|1,1,0]=4 2387 B9R1.12 OCCSc1nccs1 62a_100000211983_100000211926 [0,1,0,0,1,0|1,1,0]=4 2388 B9R1.12 OCCSc1ncns1 62a_100000211926_100000693119 [0,1,0,0,1,0|1,1,0]=4 2389 B9R1.12 OCCSc1ncns1 62a_100000693119_100000211926 [0,1,0,0,1,0|1,1,0]=4 2390 B9R1.12 [13CH3]NCCc1ccco1 2230a_100000694680_200025704644 [0,1,0,0,1,0|2,0,0]=4 2391 B9R1.12 [13CH3]NCCc1ccco1 34a_100000694680_200025704644 [0,1,0,0,1,0|2,0,0]=4 2392 B9R1.12 [13CH3]NCCc1cccs1 2230a_100000203755_200025704644 [0,1,0,0,1,0|2,0,0]=4 2393 B9R1.12 [13CH3]NCCc1cccs1 34a_100000203755_200025704644 [0,1,0,0,1,0|2,0,0]=4 2394 B9R1.12 [13CH3]NCCc1ccsc1 2230a_100000692642_200025704644 [0,1,0,0,1,0|2,0,0]=4 2395 B9R1.12 [13CH3]NCCc1ccsc1 34a_100000692642_200025704644 [0,1,0,0,1,0|2,0,0]=4 2396 B9R1.12 [13CH3]NCCc1cn[nH]c1 2230a_100000732747_200025704644 [0,1,0,0,1,0|2,0,0]=4 2397 B9R1.12 [13CH3]NCCc1cncs1 2230a_100016991637_200025704644 [0,1,0,0,1,0|2,0,0]=4 2398 B9R1.12 [13CH3]NCCc1nccs1 2230a_100015186391_200025704644 [0,1,0,0,1,0|2,0,0]=4 2399 B9R1.12 [13CH3]NCCn1cccn1 2230a_100011200920_200025704644 [0,1,0,0,1,0|2,0,0]=4 2400 B9R1.12 [13CH3]NCCn1cncn1 2230a_200000738561_200025704644 [0,1,0,0,1,0|2,0,0]=4 2401 B9R1.12 [13CH3]OCCc1cccs1 34a_100011216825_200025704644 [0,1,0,0,1,0|1,1,0]=4 2402 B9R1.12 [13CH3]OCCc1cccs1 7a_100011216825_200025704644 [0,1,0,0,1,0|1,1,0]=4 2403 B9R1.12 [13CH3]OCCc1ccsc1 34a_100000748821_200025704644 [0,1,0,0,1,0|1,1,0]=4 2404 B9R1.12 [13CH3]OCCc1cn[nH]c1 34a_100000766553_200025704644 [0,1,0,0,1,0|1,1,0]=4 2405 B9R1.12 [13CH3]OCCc1cnoc1 34a_100000732699_200025704644 [0,1,0,0,1,0|1,1,0]=4 2406 B9R1.12 [13CH3]OCCc1ncc[nH]1 34a_103549771195_200025704644 [0,1,0,0,1,0|0,1,1]=4 2407 B9R1.12 [13CH3]OCCn1cccn1 34a_100000743371_200025704644 [0,1,0,0,1,0|1,1,0]=4 2408 B9R1.12 [13CH3]OCCn1ccnc1 34a_100000719764_200025704644 [0,1,0,0,1,0|1,1,0]=4 2409 B9R1.12 [13CH3]OCCn1cncn1 34a_100000745309_200025704644 [0,1,0,0,1,0|1,1,0]=4 2410 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_100020628418_200025704644 [0,1,0,0,1,0|0,0,1]=3 2411 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_200025704644_100020628418 [0,1,0,0,1,0|0,0,1]=3 2412 B9R1.12 [13CH3]SCCc1cccs1 62a_100000748579_200025704644 [0,1,0,0,1,0|1,0,0]=3 2413 B9R1.12 [13CH3]SCCc1cccs1 62a_200025704644_100000748579 [0,1,0,0,1,0|1,0,0]=3 2414 B9R1.12 [13CH3]SCCc1cn[nH]c1 62a_100000743252_200025704644 [0,1,0,0,1,0|1,0,0]=3 2415 B9R1.12 [13CH3]SCCc1cn[nH]c1 62a_200025704644_100000743252 [0,1,0,0,1,0|1,0,0]=3 2416 B9R1.12 [13CH3]SCCc1nnn[nH]1 62a_100000031946_200025704644 [0,1,0,0,1,0|2,0,0]=4 2417 B9R1.12 [13CH3]SCCc1nnn[nH]1 62a_200025704644_100000031946 [0,1,0,0,1,0|2,0,0]=4 2418 B9R1.12 [13CH3]SCCn1cccc1 62a_200009811947_200025704644 [0,1,0,0,1,0|2,0,0]=4 2419 B9R1.12 [13CH3]SCCn1cccc1 62a_200025704644_200000035178 [0,1,0,0,1,0|2,0,0]=4 2420 B9R1.12 [13CH3]SCCn1cccn1 62a_100015204718_200025704644 [0,1,0,0,1,0|1,0,0]=3 2421 B9R1.12 [13CH3]SCCn1cccn1 62a_200025704644_100000685285 [0,1,0,0,1,0|1,0,0]=3 2422 B9R1.12 [13CH3]SCCn1ccnc1 62a_100000702546_200025704644 [0,1,0,0,1,0|1,0,0]=3 2423 B9R1.12 [13CH3]SCCn1ccnc1 62a_200025704644_100000702546 [0,1,0,0,1,0|1,0,0]=3 2424 B9R1.12 [13CH3]SCCn1cncn1 62a_100000731791_200025704644 [0,1,0,0,1,0|1,0,0]=3 2425 B9R1.12 [13CH3]SCCn1cncn1 62a_200025704644_100000731791 [0,1,0,0,1,0|1,0,0]=3 2426 B11R1.1 C#CCNc1cnc(cn1)Br 27a_100000212058_100010187541 [0,2,0,0,0,0|1,0,1]=4 2427 B11R1.1 C#CCNc1cnc(cn1)C 27a_100000212058_100000074397 [0,2,0,0,0,0|1,0,1]=4 2428 B11R1.1 C#CCNc1cnc(cn1)F 27a_100000212058_100009856528 [0,2,0,0,0,0|1,0,1]=4 2429 B11R1.1 C#CCOc1cnc(cn1)Br 34a_100011934580_100000184674 [0,2,0,0,0,0|1,0,1]=4 2430 B11R1.1 C#CCOc1cnc(cn1)Cl 34a_100015839800_100000184674 [0,2,0,0,0,0|1,0,1]=4 2431 B11R1.1 C#CCSc1cnc(cn1)Br 62a_100000038162_100010187541 [0,2,0,0,0,0|1,0,1]=4 2432 B11R1.1 C#CCSc1cnc(cn1)C 62a_100000038162_100011999403 [0,2,0,0,0,0|1,0,1]=4 2433 B11R1.1 C#CCSc1cnc(cn1)Cl 62a_100000038162_100010214907 [0,2,0,0,0,0|1,0,1]=4 2434 B11R1.1 C#CCSc1cnc(cn1)F 62a_100000038162_100009856528 [0,2,0,0,0,0|1,0,1]=4 2435 B11R1.1 C#CCSc1cnc(cn1)N 62a_100000038162_100000744751 [0,2,0,0,0,0|1,0,1]=4 2436 B11R1.1 C#CCSc1cnc(cn1)O 62a_100000038162_100015839800 [0,2,0,0,0,0|1,0,1]=4 2437 B11R1.1 C=CCNc1cnc(cn1)Br 27a_100020586998_100010187541 [0,2,0,0,0,0|1,0,1]=4 2438 B11R1.1 C=CCNc1cnc(cn1)C 27a_100020586998_100000074397 [0,2,0,0,0,0|1,0,1]=4 2439 B11R1.1 C=CCNc1cnc(cn1)F 27a_100020586998_100009856528 [0,2,0,0,0,0|1,0,1]=4 2440 B11R1.1 C=CCOc1cnc(cn1)Br 34a_100011934580_100015514636 [0,2,0,0,0,0|1,0,1]=4 2441 B11R1.1 C=CCOc1cnc(cn1)Cl 34a_100015839800_100015514636 [0,2,0,0,0,0|1,0,1]=4 2442 B11R1.1 C=CCSc1cnc(cn1)Br 62a_100000210623_100010187541 [0,2,0,0,0,0|1,0,1]=4 2443 B11R1.1 C=CCSc1cnc(cn1)Br 62a_100010187541_100000210623 [0,2,0,0,0,0|1,0,1]=4 2444 B11R1.1 C=CCSc1cnc(cn1)C 62a_100000210623_100011999403 [0,2,0,0,0,0|1,0,1]=4 2445 B11R1.1 C=CCSc1cnc(cn1)C 62a_100011999403_100000210623 [0,2,0,0,0,0|1,0,1]=4 2446 B11R1.1 C=CCSc1cnc(cn1)Cl 62a_100000210623_100010214907 [0,2,0,0,0,0|1,0,1]=4 2447 B11R1.1 C=CCSc1cnc(cn1)Cl 62a_100010214907_100000210623 [0,2,0,0,0,0|1,0,1]=4 2448 B11R1.1 C=CCSc1cnc(cn1)F 62a_100000210623_100009856528 [0,2,0,0,0,0|1,0,1]=4 2449 B11R1.1 C=CCSc1cnc(cn1)F 62a_100009856528_100000210623 [0,2,0,0,0,0|1,0,1]=4 2450 B11R1.1 C=CCSc1cnc(cn1)N 62a_100000210623_100000744751 [0,2,0,0,0,0|1,0,1]=4 2451 B11R1.1 C=CCSc1cnc(cn1)N 62a_100000744751_100000210623 [0,2,0,0,0,0|1,0,1]=4 2452 B11R1.1 C=CCSc1cnc(cn1)O 62a_100000210623_100015839800 [0,2,0,0,0,0|1,0,1]=4 2453 B11R1.1 C=CCSc1cnc(cn1)O 62a_100011934580_100000210623 [0,2,0,0,0,0|1,0,1]=4 2454 B11R1.1 CCCCc1ccc(cn1)Br 271570a_100020621405_100000686858 [0,2,0,0,0,0|2,0,0]=4 2455 B11R1.1 CCCCc1ccc(cn1)C 271570a_100020621405_100000754016 [0,2,0,0,0,0|2,0,0]=4 2456 B11R1.1 CCCCc1ccc(cn1)Cl 271570a_100020621405_100011356976 [0,2,0,0,0,0|2,0,0]=4 2457 B11R1.1 CCCCc1ccc(cn1)F 271570a_100020621405_100000744514 [0,2,0,0,0,0|2,0,0]=4 2458 B11R1.1 CCCCc1ccc(cn1)N 271570a_100020621405_100000744251 [0,2,0,0,0,0|2,0,0]=4 2459 B11R1.1 CCCCc1ccc(cn1)O 271570a_100020621405_100000685995 [0,2,0,0,0,0|2,0,0]=4 2460 B11R1.1 CCCCc1ccc(nc1)Br 271570a_100020621405_100009814638 [0,2,0,0,0,0|2,0,0]=4 2461 B11R1.1 CCCCc1ccc(nc1)C 271570a_100020621405_100000751577 [0,2,0,0,0,0|2,0,0]=4 2462 B11R1.1 CCCCc1ccc(nc1)Cl 271570a_100020621405_100000034144 [0,2,0,0,0,0|2,0,0]=4 2463 B11R1.1 CCCCc1ccc(nc1)F 271570a_100020621405_100000748661 [0,2,0,0,0,0|2,0,0]=4 2464 B11R1.1 CCCCc1ccc(nc1)N 271570a_100020621405_100000187370 [0,2,0,0,0,0|2,0,0]=4 2465 B11R1.1 CCCCc1cnc(cn1)C 271570a_100020621405_100011999403 [0,2,0,0,0,0|1,0,0]=3 2466 B11R1.1 CCCCc1cnc(cn1)F 271570a_100020621405_100009856528 [0,2,0,0,0,0|1,0,0]=3 2467 B11R1.1 CCCCc1cnc(cn1)N 271570a_100020621405_100000761932 [0,2,0,0,0,0|1,0,0]=3 2468 B11R1.1 CCCCc1cnc(nn1)N 271570a_100020621405_100000691435 [0,2,0,0,0,0|2,0,0]=4 2469 B11R1.1 CCCOc1ccc(cn1)C 34a_100000759353_100000210303 [0,2,0,0,0,0|2,0,0]=4 2470 B11R1.1 CCCOc1ccc(cn1)Cl 34a_100011215309_100000210303 [0,2,0,0,0,0|2,0,0]=4 2471 B11R1.1 CCCOc1ccc(cn1)F 34a_100000742473_100000210303 [0,2,0,0,0,0|2,0,0]=4 2472 B11R1.1 CCCOc1ccc(cn1)N 34a_100000729260_100000210303 [0,2,0,0,0,0|2,0,0]=4 2473 B11R1.1 CCCOc1ccc(cn1)O 271570a_203496583355_100011465619 [0,2,0,0,0,0|2,0,0]=4 2474 B11R1.1 CCCOc1ccc(nc1)Br 34a_100000685995_100000210303 [0,2,0,0,0,0|2,0,0]=4 2475 B11R1.1 CCCOc1ccc(nc1)Br 7a_100000685995_100000210303 [0,2,0,0,0,0|2,0,0]=4 2476 B11R1.1 CCCOc1ccc(nc1)C 34a_100000745506_100000210303 [0,2,0,0,0,0|2,0,0]=4 2477 B11R1.1 CCCOc1ccc(nc1)C 7a_100000745506_100000210303 [0,2,0,0,0,0|2,0,0]=4 2478 B11R1.1 CCCOc1ccc(nc1)Cl 34a_100000744096_100000210303 [0,2,0,0,0,0|2,0,0]=4 2479 B11R1.1 CCCOc1ccc(nc1)Cl 7a_100000744096_100000210303 [0,2,0,0,0,0|2,0,0]=4 2480 B11R1.1 CCCOc1ccc(nc1)F 34a_100000688820_100000210303 [0,2,0,0,0,0|2,0,0]=4 2481 B11R1.1 CCCOc1ccc(nc1)F 7a_100000688820_100000210303 [0,2,0,0,0,0|2,0,0]=4 2482 B11R1.1 CCCOc1ccc(nc1)I 34a_100000687607_100000210303 [0,2,0,0,0,0|2,0,0]=4 2483 B11R1.1 CCCOc1ccc(nc1)I 7a_100000687607_100000210303 [0,2,0,0,0,0|2,0,0]=4 2484 B11R1.1 CCCOc1ccc(nc1)N 34a_100015188713_100000210303 [0,2,0,0,0,0|2,0,0]=4 2485 B11R1.1 CCCOc1ccc(nc1)N 7a_100015188713_100000210303 [0,2,0,0,0,0|2,0,0]=4 2486 B11R1.1 CCCOc1ccc(nc1)O 271570a_203496583355_100000719977 [0,2,0,0,0,0|2,0,0]=4 2487 B11R1.1 CCCOc1cnc(cn1)Br 34a_100011934580_100000210303 [0,2,0,0,0,0|1,0,0]=3 2488 B11R1.1 CCCOc1cnc(cn1)Cl 34a_100015839800_100000210303 [0,2,0,0,0,0|1,0,0]=3 2489 B11R1.1 CCCSc1ccc(cn1)Br 62a_100000210303_100000686858 [0,2,0,0,0,0|2,0,0]=4 2490 B11R1.1 CCCSc1ccc(cn1)Br 62a_100000686858_100000210303 [0,2,0,0,0,0|2,0,0]=4 2491 B11R1.1 CCCSc1ccc(cn1)C 62a_100000210303_100000754016 [0,2,0,0,0,0|2,0,0]=4 2492 B11R1.1 CCCSc1ccc(cn1)C 62a_100011192072_100000210303 [0,2,0,0,0,0|2,0,0]=4 2493 B11R1.1 CCCSc1ccc(cn1)Cl 62a_100000210303_100011356976 [0,2,0,0,0,0|2,0,0]=4 2494 B11R1.1 CCCSc1ccc(cn1)Cl 62a_100011356976_100000210303 [0,2,0,0,0,0|2,0,0]=4 2495 B11R1.1 CCCSc1ccc(cn1)F 62a_100000210303_100000744514 [0,2,0,0,0,0|2,0,0]=4 2496 B11R1.1 CCCSc1ccc(cn1)F 62a_100000744514_100000210303 [0,2,0,0,0,0|2,0,0]=4 2497 B11R1.1 CCCSc1ccc(cn1)N 62a_100000210303_100000737798 [0,2,0,0,0,0|2,0,0]=4 2498 B11R1.1 CCCSc1ccc(cn1)N 62a_100000737798_100000210303 [0,2,0,0,0,0|2,0,0]=4 2499 B11R1.1 CCCSc1ccc(cn1)O 62a_100000210303_100000744096 [0,2,0,0,0,0|2,0,0]=4 2500 B11R1.1 CCCSc1ccc(cn1)O 62a_100000685995_100000210303 [0,2,0,0,0,0|2,0,0]=4 2501 B11R1.1 CCCSc1ccc(nc1)Br 62a_100000210303_100009814638 [0,2,0,0,0,0|2,0,0]=4 2502 B11R1.1 CCCSc1ccc(nc1)Br 62a_100009814638_100000210303 [0,2,0,0,0,0|2,0,0]=4 2503 B11R1.1 CCCSc1ccc(nc1)C 62a_100000210303_100000751577 [0,2,0,0,0,0|2,0,0]=4 2504 B11R1.1 CCCSc1ccc(nc1)C 62a_100000751577_100000210303 [0,2,0,0,0,0|2,0,0]=4 2505 B11R1.1 CCCSc1ccc(nc1)Cl 62a_100000034144_100000210303 [0,2,0,0,0,0|2,0,0]=4 2506 B11R1.1 CCCSc1ccc(nc1)Cl 62a_100000210303_100000034144 [0,2,0,0,0,0|2,0,0]=4 2507 B11R1.1 CCCSc1ccc(nc1)F 62a_100000042367_100000210303 [0,2,0,0,0,0|2,0,0]=4 2508 B11R1.1 CCCSc1ccc(nc1)F 62a_100000210303_100000042367 [0,2,0,0,0,0|2,0,0]=4 2509 B11R1.1 CCCSc1ccc(nc1)N 62a_100000187370_100000210303 [0,2,0,0,0,0|2,0,0]=4 2510 B11R1.1 CCCSc1ccc(nc1)N 62a_100000210303_100000187370 [0,2,0,0,0,0|2,0,0]=4 2511 B11R1.1 CCCSc1cnc(cn1)Br 62a_100000210303_100010187541 [0,2,0,0,0,0|1,0,0]=3 2512 B11R1.1 CCCSc1cnc(cn1)Br 62a_100010187541_100000210303 [0,2,0,0,0,0|1,0,0]=3 2513 B11R1.1 CCCSc1cnc(cn1)C 62a_100000210303_100011999403 [0,2,0,0,0,0|1,0,0]=3 2514 B11R1.1 CCCSc1cnc(cn1)C 62a_100011999403_100000210303 [0,2,0,0,0,0|1,0,0]=3 2515 B11R1.1 CCCSc1cnc(cn1)Cl 62a_100000210303_100010214907 [0,2,0,0,0,0|1,0,0]=3 2516 B11R1.1 CCCSc1cnc(cn1)Cl 62a_100010214907_100000210303 [0,2,0,0,0,0|1,0,0]=3 2517 B11R1.1 CCCSc1cnc(cn1)F 62a_100000210303_100009856528 [0,2,0,0,0,0|1,0,0]=3 2518 B11R1.1 CCCSc1cnc(cn1)F 62a_100009856528_100000210303 [0,2,0,0,0,0|1,0,0]=3 2519 B11R1.1 CCCSc1cnc(cn1)N 62a_100000210303_100000744751 [0,2,0,0,0,0|1,0,0]=3 2520 B11R1.1 CCCSc1cnc(cn1)N 62a_100000744751_100000210303 [0,2,0,0,0,0|1,0,0]=3 2521 B11R1.1 CCCSc1cnc(cn1)O 62a_100000210303_100015839800 [0,2,0,0,0,0|1,0,0]=3 2522 B11R1.1 CCCSc1cnc(cn1)O 62a_100011934580_100000210303 [0,2,0,0,0,0|1,0,0]=3 2523 B11R1.1 CCCSc1cnc(nn1)N 62a_100000210303_100000691435 [0,2,0,0,0,0|2,0,0]=4 2524 B11R1.1 CCCSc1cnc(nn1)N 62a_100000691435_100000210303 [0,2,0,0,0,0|2,0,0]=4 2525 B11R1.1 CCNCc1ccc(cn1)Br 207a_100015525214_100000754260 [0,2,0,0,0,0|2,0,0]=4 2526 B11R1.1 CCNCc1ccc(cn1)Br 2230a_100015525214_100000702658 [0,2,0,0,0,0|2,0,0]=4 2527 B11R1.1 CCNCc1ccc(cn1)Br 270004a_100015525214_100000754260 [0,2,0,0,0,0|2,0,0]=4 2528 B11R1.1 CCNCc1ccc(cn1)Br 34a_100015188789_100000210202 [0,2,0,0,0,0|2,0,0]=4 2529 B11R1.1 CCNCc1ccc(cn1)C 207a_100015525214_100000050478 [0,2,0,0,0,0|2,0,0]=4 2530 B11R1.1 CCNCc1ccc(cn1)C 2230a_100015525214_100000691093 [0,2,0,0,0,0|2,0,0]=4 2531 B11R1.1 CCNCc1ccc(cn1)C 270004a_100015525214_100000050478 [0,2,0,0,0,0|2,0,0]=4 2532 B11R1.1 CCNCc1ccc(cn1)C 34a_100015187455_100000210202 [0,2,0,0,0,0|2,0,0]=4 2533 B11R1.1 CCNCc1ccc(cn1)Cl 207a_100015525214_100011361569 [0,2,0,0,0,0|2,0,0]=4 2534 B11R1.1 CCNCc1ccc(cn1)Cl 2230a_100015525214_100012066911 [0,2,0,0,0,0|2,0,0]=4 2535 B11R1.1 CCNCc1ccc(cn1)Cl 270004a_100015525214_100011361569 [0,2,0,0,0,0|2,0,0]=4 2536 B11R1.1 CCNCc1ccc(cn1)Cl 34a_100000697193_100000210202 [0,2,0,0,0,0|2,0,0]=4 2537 B11R1.1 CCNCc1ccc(cn1)F 207a_100015525214_100011934744 [0,2,0,0,0,0|2,0,0]=4 2538 B11R1.1 CCNCc1ccc(cn1)F 2230a_100015525214_100000703193 [0,2,0,0,0,0|2,0,0]=4 2539 B11R1.1 CCNCc1ccc(cn1)F 270004a_100015525214_100011934744 [0,2,0,0,0,0|2,0,0]=4 2540 B11R1.1 CCNCc1ccc(cn1)F 34a_100020620131_100000210202 [0,2,0,0,0,0|2,0,0]=4 2541 B11R1.1 CCNCc1ccc(nc1)Br 2230a_100009817727_100000210202 [0,2,0,0,0,0|2,0,0]=4 2542 B11R1.1 CCNCc1ccc(nc1)Br 2230a_100015525214_100009831999 [0,2,0,0,0,0|2,0,0]=4 2543 B11R1.1 CCNCc1ccc(nc1)Br 34a_100009817727_100000210202 [0,2,0,0,0,0|2,0,0]=4 2544 B11R1.1 CCNCc1ccc(nc1)C 2230a_100015525214_100016987292 [0,2,0,0,0,0|2,0,0]=4 2545 B11R1.1 CCNCc1ccc(nc1)C 270004a_100015525214_100000743784 [0,2,0,0,0,0|2,0,0]=4 2546 B11R1.1 CCNCc1ccc(nc1)C 34a_100000740942_100000210202 [0,2,0,0,0,0|2,0,0]=4 2547 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100000735879_100000210202 [0,2,0,0,0,0|2,0,0]=4 2548 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100015525214_100000735431 [0,2,0,0,0,0|2,0,0]=4 2549 B11R1.1 CCNCc1ccc(nc1)Cl 34a_100000735879_100000210202 [0,2,0,0,0,0|2,0,0]=4 2550 B11R1.1 CCNCc1ccc(nc1)F 2230a_100000101913_100000210202 [0,2,0,0,0,0|2,0,0]=4 2551 B11R1.1 CCNCc1ccc(nc1)F 2230a_100015525214_100009820150 [0,2,0,0,0,0|2,0,0]=4 2552 B11R1.1 CCNCc1ccc(nc1)F 34a_100000101913_100000210202 [0,2,0,0,0,0|2,0,0]=4 2553 B11R1.1 CCNCc1ccc(nc1)O 207a_100015525214_100011361521 [0,2,0,0,0,0|2,0,0]=4 2554 B11R1.1 CCNCc1ccc(nc1)O 2230a_100000757128_100000210202 [0,2,0,0,0,0|2,0,0]=4 2555 B11R1.1 CCNCc1cnc(cn1)C 2230a_100015525214_100000752025 [0,2,0,0,0,0|1,0,0]=3 2556 B11R1.1 CCNCc1cnc(cn1)C 270004a_100015525214_100000685221 [0,2,0,0,0,0|1,0,0]=3 2557 B11R1.1 CCNCc1cnc(cn1)C 34a_100132314150_100000210202 [0,2,0,0,0,0|1,0,0]=3 2558 B11R1.1 CCNCc1cnc(cn1)Cl 270004a_100015525214_100012001714 [0,2,0,0,0,0|1,0,0]=3 2559 B11R1.1 CCOCc1ccc(cn1)Br 34a_100000754261_100000210202 [0,2,0,0,0,0|2,0,0]=4 2560 B11R1.1 CCOCc1ccc(cn1)Br 34a_100121572206_100000702658 [0,2,0,0,0,0|2,0,0]=4 2561 B11R1.1 CCOCc1ccc(cn1)C 34a_100012001401_100000210202 [0,2,0,0,0,0|2,0,0]=4 2562 B11R1.1 CCOCc1ccc(cn1)C 34a_100121572206_100000691093 [0,2,0,0,0,0|2,0,0]=4 2563 B11R1.1 CCOCc1ccc(cn1)Cl 34a_100000703999_100000210202 [0,2,0,0,0,0|2,0,0]=4 2564 B11R1.1 CCOCc1ccc(cn1)Cl 34a_100121572206_100012066911 [0,2,0,0,0,0|2,0,0]=4 2565 B11R1.1 CCOCc1ccc(cn1)F 34a_100011999454_100000210202 [0,2,0,0,0,0|2,0,0]=4 2566 B11R1.1 CCOCc1ccc(cn1)F 34a_100121572206_100000703193 [0,2,0,0,0,0|2,0,0]=4 2567 B11R1.1 CCOCc1ccc(cn1)N 34a_100011998161_100000210202 [0,2,0,0,0,0|2,0,0]=4 2568 B11R1.1 CCOCc1ccc(nc1)Br 34a_100009816760_100000210202 [0,2,0,0,0,0|2,0,0]=4 2569 B11R1.1 CCOCc1ccc(nc1)Br 34a_100121572206_100009831999 [0,2,0,0,0,0|2,0,0]=4 2570 B11R1.1 CCOCc1ccc(nc1)Br 7a_100009816760_100000210202 [0,2,0,0,0,0|2,0,0]=4 2571 B11R1.1 CCOCc1ccc(nc1)C 34a_100011248133_100000210202 [0,2,0,0,0,0|2,0,0]=4 2572 B11R1.1 CCOCc1ccc(nc1)C 34a_100121572206_100016987292 [0,2,0,0,0,0|2,0,0]=4 2573 B11R1.1 CCOCc1ccc(nc1)Cl 34a_100000755211_100000210202 [0,2,0,0,0,0|2,0,0]=4 2574 B11R1.1 CCOCc1ccc(nc1)Cl 34a_100121572206_100000735431 [0,2,0,0,0,0|2,0,0]=4 2575 B11R1.1 CCOCc1ccc(nc1)Cl 7a_100000755211_100000210202 [0,2,0,0,0,0|2,0,0]=4 2576 B11R1.1 CCOCc1ccc(nc1)F 34a_100000079959_100000210202 [0,2,0,0,0,0|2,0,0]=4 2577 B11R1.1 CCOCc1ccc(nc1)F 34a_100121572206_100000099788 [0,2,0,0,0,0|2,0,0]=4 2578 B11R1.1 CCOCc1ccc(nc1)N 34a_100000704267_100000210202 [0,2,0,0,0,0|2,0,0]=4 2579 B11R1.1 CCOCc1ccc(nc1)O 271570a_203496583355_100011206209 [0,2,0,0,0,0|2,0,0]=4 2580 B11R1.1 CCOCc1cnc(cn1)C 34a_100011273949_100000210202 [0,2,0,0,0,0|1,0,0]=3 2581 B11R1.1 CCOCc1cnc(cn1)Cl 34a_100012002382_100000210202 [0,2,0,0,0,0|1,0,0]=3 2582 B11R1.1 CCSCc1ccc(cn1)Br 62a_100000210202_100000702658 [0,2,0,0,0,0|2,0,0]=4 2583 B11R1.1 CCSCc1ccc(cn1)Br 62a_100000702658_100000210202 [0,2,0,0,0,0|2,0,0]=4 2584 B11R1.1 CCSCc1ccc(cn1)C 62a_100000210202_100000691093 [0,2,0,0,0,0|2,0,0]=4 2585 B11R1.1 CCSCc1ccc(cn1)C 62a_100000691093_100000210202 [0,2,0,0,0,0|2,0,0]=4 2586 B11R1.1 CCSCc1ccc(cn1)Cl 62a_100000210202_100000697101 [0,2,0,0,0,0|2,0,0]=4 2587 B11R1.1 CCSCc1ccc(cn1)Cl 62a_100012066911_100000210202 [0,2,0,0,0,0|2,0,0]=4 2588 B11R1.1 CCSCc1ccc(cn1)F 62a_100000210202_100000703193 [0,2,0,0,0,0|2,0,0]=4 2589 B11R1.1 CCSCc1ccc(cn1)F 62a_100000703193_100000210202 [0,2,0,0,0,0|2,0,0]=4 2590 B11R1.1 CCSCc1ccc(nc1)Br 62a_100000210202_100009831999 [0,2,0,0,0,0|2,0,0]=4 2591 B11R1.1 CCSCc1ccc(nc1)Br 62a_100009831999_100000210202 [0,2,0,0,0,0|2,0,0]=4 2592 B11R1.1 CCSCc1ccc(nc1)C 62a_100000210202_100016987292 [0,2,0,0,0,0|2,0,0]=4 2593 B11R1.1 CCSCc1ccc(nc1)C 62a_100016987292_100000210202 [0,2,0,0,0,0|2,0,0]=4 2594 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000210202_100000735431 [0,2,0,0,0,0|2,0,0]=4 2595 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000735431_100000210202 [0,2,0,0,0,0|2,0,0]=4 2596 B11R1.1 CCSCc1ccc(nc1)F 62a_100000210202_100000099788 [0,2,0,0,0,0|2,0,0]=4 2597 B11R1.1 CCSCc1ccc(nc1)F 62a_100009820150_100000210202 [0,2,0,0,0,0|2,0,0]=4 2598 B11R1.1 CCSCc1cnc(cn1)C 62a_100000210202_100000752025 [0,2,0,0,0,0|1,0,0]=3 2599 B11R1.1 CCSCc1cnc(cn1)C 62a_100000752025_100000210202 [0,2,0,0,0,0|1,0,0]=3 2600 B11R1.1 COCCc1ccc(cn1)Br 34a_100012357577_200000210301 [0,2,0,0,0,0|1,1,0]=4 2601 B11R1.1 COCCc1ccc(nc1)C 34a_100011815783_200000210301 [0,2,0,0,0,0|1,1,0]=4 2602 B11R1.1 COCCc1ccc(nc1)Cl 34a_100009880866_200000210301 [0,2,0,0,0,0|1,1,0]=4 2603 B11R1.1 COCCc1ccc(nc1)Cl 7a_100009880866_200000210301 [0,2,0,0,0,0|1,1,0]=4 2604 B11R1.1 COCSc1cnc(cn1)Br 62a_100000766300_100010187541 [0,2,0,0,0,0|1,1,0]=4 2605 B11R1.1 COCSc1cnc(cn1)Br 62a_100010187541_100000766300 [0,2,0,0,0,0|1,1,0]=4 2606 B11R1.1 COCSc1cnc(cn1)C 62a_100000766300_100011999403 [0,2,0,0,0,0|1,1,0]=4 2607 B11R1.1 COCSc1cnc(cn1)C 62a_100011999403_100000766300 [0,2,0,0,0,0|1,1,0]=4 2608 B11R1.1 COCSc1cnc(cn1)Cl 62a_100000766300_100010214907 [0,2,0,0,0,0|1,1,0]=4 2609 B11R1.1 COCSc1cnc(cn1)Cl 62a_100010214907_100000766300 [0,2,0,0,0,0|1,1,0]=4 2610 B11R1.1 COCSc1cnc(cn1)F 62a_100000766300_100009856528 [0,2,0,0,0,0|1,1,0]=4 2611 B11R1.1 COCSc1cnc(cn1)F 62a_100009856528_100000766300 [0,2,0,0,0,0|1,1,0]=4 2612 B11R1.1 COCSc1cnc(cn1)N 62a_100000744751_100000766300 [0,2,0,0,0,0|1,1,0]=4 2613 B11R1.1 COCSc1cnc(cn1)N 62a_100000766300_100000744751 [0,2,0,0,0,0|1,1,0]=4 2614 B11R1.1 COCSc1cnc(cn1)O 62a_100000766300_100015839800 [0,2,0,0,0,0|1,1,0]=4 2615 B11R1.1 COCSc1cnc(cn1)O 62a_100011934580_100000766300 [0,2,0,0,0,0|1,1,0]=4 2616 B11R1.1 CSCCc1ccc(cc1)Br 62a_100011740612_200000210301 [0,2,0,0,0,0|2,0,0]=4 2617 B11R1.1 CSCCc1ccc(cc1)Br 62a_200000210301_100011740612 [0,2,0,0,0,0|2,0,0]=4 2618 B11R1.1 CSCCc1ccc(cc1)C 62a_100011713686_200000210301 [0,2,0,0,0,0|2,0,0]=4 2619 B11R1.1 CSCCc1ccc(cc1)C 62a_200000210301_100011713686 [0,2,0,0,0,0|2,0,0]=4 2620 B11R1.1 CSCCc1ccc(cc1)Cl 62a_100011713675_200000210301 [0,2,0,0,0,0|2,0,0]=4 2621 B11R1.1 CSCCc1ccc(cc1)Cl 62a_200000210301_100011713675 [0,2,0,0,0,0|2,0,0]=4 2622 B11R1.1 CSCCc1ccc(cc1)F 62a_100011217392_200000210301 [0,2,0,0,0,0|2,0,0]=4 2623 B11R1.1 CSCCc1ccc(cc1)F 62a_200000210301_100011217392 [0,2,0,0,0,0|2,0,0]=4 2624 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [0,2,0,0,0,0|2,0,0]=4 2625 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [0,2,0,0,0,0|2,0,0]=4 2626 B11R1.1 CSCOc1ccc(cn1)C 34a_100000759353_100011218213 [0,2,0,0,0,0|2,0,0]=4 2627 B11R1.1 CSCOc1ccc(cn1)Cl 34a_100011215309_100011218213 [0,2,0,0,0,0|2,0,0]=4 2628 B11R1.1 CSCOc1ccc(cn1)F 34a_100000742473_100011218213 [0,2,0,0,0,0|2,0,0]=4 2629 B11R1.1 CSCOc1ccc(cn1)N 34a_100000729260_100011218213 [0,2,0,0,0,0|2,0,0]=4 2630 B11R1.1 CSCOc1ccc(nc1)Br 34a_100000685995_100011218213 [0,2,0,0,0,0|2,0,0]=4 2631 B11R1.1 CSCOc1ccc(nc1)C 34a_100000745506_100011218213 [0,2,0,0,0,0|2,0,0]=4 2632 B11R1.1 CSCOc1ccc(nc1)Cl 34a_100000744096_100011218213 [0,2,0,0,0,0|2,0,0]=4 2633 B11R1.1 CSCOc1ccc(nc1)F 34a_100000688820_100011218213 [0,2,0,0,0,0|2,0,0]=4 2634 B11R1.1 CSCOc1ccc(nc1)I 34a_100000687607_100011218213 [0,2,0,0,0,0|2,0,0]=4 2635 B11R1.1 CSCOc1ccc(nc1)N 34a_100015188713_100011218213 [0,2,0,0,0,0|2,0,0]=4 2636 B11R1.1 CSCOc1cnc(cn1)Br 34a_100011934580_100011218213 [0,2,0,0,0,0|1,0,0]=3 2637 B11R1.1 CSCOc1cnc(cn1)Cl 34a_100015839800_100011218213 [0,2,0,0,0,0|1,0,0]=3 2638 B11R1.1 CSCSc1ccc(cn1)Br 62a_100000686858_100011218213 [0,2,0,0,0,0|2,0,0]=4 2639 B11R1.1 CSCSc1ccc(cn1)Br 62a_100011218213_100000686858 [0,2,0,0,0,0|2,0,0]=4 2640 B11R1.1 CSCSc1ccc(cn1)C 62a_100011192072_100011218213 [0,2,0,0,0,0|2,0,0]=4 2641 B11R1.1 CSCSc1ccc(cn1)C 62a_100011218213_100000754016 [0,2,0,0,0,0|2,0,0]=4 2642 B11R1.1 CSCSc1ccc(cn1)Cl 62a_100011218213_100011356976 [0,2,0,0,0,0|2,0,0]=4 2643 B11R1.1 CSCSc1ccc(cn1)Cl 62a_100011356976_100011218213 [0,2,0,0,0,0|2,0,0]=4 2644 B11R1.1 CSCSc1ccc(cn1)F 62a_100000744514_100011218213 [0,2,0,0,0,0|2,0,0]=4 2645 B11R1.1 CSCSc1ccc(cn1)F 62a_100011218213_100000744514 [0,2,0,0,0,0|2,0,0]=4 2646 B11R1.1 CSCSc1ccc(cn1)N 62a_100000737798_100011218213 [0,2,0,0,0,0|2,0,0]=4 2647 B11R1.1 CSCSc1ccc(cn1)N 62a_100011218213_100000737798 [0,2,0,0,0,0|2,0,0]=4 2648 B11R1.1 CSCSc1ccc(cn1)O 62a_100000685995_100011218213 [0,2,0,0,0,0|2,0,0]=4 2649 B11R1.1 CSCSc1ccc(cn1)O 62a_100011218213_100000744096 [0,2,0,0,0,0|2,0,0]=4 2650 B11R1.1 CSCSc1ccc(nc1)Br 62a_100009814638_100011218213 [0,2,0,0,0,0|2,0,0]=4 2651 B11R1.1 CSCSc1ccc(nc1)Br 62a_100011218213_100009814638 [0,2,0,0,0,0|2,0,0]=4 2652 B11R1.1 CSCSc1ccc(nc1)C 62a_100000751577_100011218213 [0,2,0,0,0,0|2,0,0]=4 2653 B11R1.1 CSCSc1ccc(nc1)C 62a_100011218213_100000751577 [0,2,0,0,0,0|2,0,0]=4 2654 B11R1.1 CSCSc1ccc(nc1)Cl 62a_100000034144_100011218213 [0,2,0,0,0,0|2,0,0]=4 2655 B11R1.1 CSCSc1ccc(nc1)Cl 62a_100011218213_100000034144 [0,2,0,0,0,0|2,0,0]=4 2656 B11R1.1 CSCSc1ccc(nc1)F 62a_100000042367_100011218213 [0,2,0,0,0,0|2,0,0]=4 2657 B11R1.1 CSCSc1ccc(nc1)F 62a_100011218213_100000042367 [0,2,0,0,0,0|2,0,0]=4 2658 B11R1.1 CSCSc1ccc(nc1)N 62a_100000187370_100011218213 [0,2,0,0,0,0|2,0,0]=4 2659 B11R1.1 CSCSc1ccc(nc1)N 62a_100011218213_100000187370 [0,2,0,0,0,0|2,0,0]=4 2660 B11R1.1 CSCSc1cnc(cn1)Br 62a_100010187541_100011218213 [0,2,0,0,0,0|1,0,0]=3 2661 B11R1.1 CSCSc1cnc(cn1)Br 62a_100011218213_100010187541 [0,2,0,0,0,0|1,0,0]=3 2662 B11R1.1 CSCSc1cnc(cn1)C 62a_100011218213_100011999403 [0,2,0,0,0,0|1,0,0]=3 2663 B11R1.1 CSCSc1cnc(cn1)C 62a_100011999403_100011218213 [0,2,0,0,0,0|1,0,0]=3 2664 B11R1.1 CSCSc1cnc(cn1)Cl 62a_100010214907_100011218213 [0,2,0,0,0,0|1,0,0]=3 2665 B11R1.1 CSCSc1cnc(cn1)Cl 62a_100011218213_100010214907 [0,2,0,0,0,0|1,0,0]=3 2666 B11R1.1 CSCSc1cnc(cn1)F 62a_100009856528_100011218213 [0,2,0,0,0,0|1,0,0]=3 2667 B11R1.1 CSCSc1cnc(cn1)F 62a_100011218213_100009856528 [0,2,0,0,0,0|1,0,0]=3 2668 B11R1.1 CSCSc1cnc(cn1)N 62a_100000744751_100011218213 [0,2,0,0,0,0|1,0,0]=3 2669 B11R1.1 CSCSc1cnc(cn1)N 62a_100011218213_100000744751 [0,2,0,0,0,0|1,0,0]=3 2670 B11R1.1 CSCSc1cnc(cn1)O 62a_100011218213_100015839800 [0,2,0,0,0,0|1,0,0]=3 2671 B11R1.1 CSCSc1cnc(cn1)O 62a_100011934580_100011218213 [0,2,0,0,0,0|1,0,0]=3 2672 B11R1.1 CSCSc1cnc(nn1)N 62a_100000691435_100011218213 [0,2,0,0,0,0|2,0,0]=4 2673 B11R1.1 CSCSc1cnc(nn1)N 62a_100011218213_100000691435 [0,2,0,0,0,0|2,0,0]=4 2674 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_100011713686_200025704644 [0,2,0,0,0,0|2,0,0]=4 2675 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713686 [0,2,0,0,0,0|2,0,0]=4 2676 B11R1.1 Cc1ccc(cn1)CCO[13CH3] 34a_100011815783_200025704644 [0,2,0,0,0,0|1,1,0]=4 2677 B11R1.1 Cc1ccc(cn1)CNCF 34a_100000740942_100015361967 [0,2,0,0,0,0|2,0,0]=4 2678 B11R1.1 Cc1ccc(cn1)COCF 34a_100011248133_100015361967 [0,2,0,0,0,0|2,0,0]=4 2679 B11R1.1 Cc1ccc(cn1)CSCF 62a_100015361967_100016987292 [0,2,0,0,0,0|2,0,0]=4 2680 B11R1.1 Cc1ccc(cn1)CSCF 62a_100016987292_100015361967 [0,2,0,0,0,0|2,0,0]=4 2681 B11R1.1 Cc1ccc(cn1)OCCF 34a_100000745506_100011217306 [0,2,0,0,0,0|2,0,0]=4 2682 B11R1.1 Cc1ccc(cn1)OCCF 7a_100000745506_100011217306 [0,2,0,0,0,0|2,0,0]=4 2683 B11R1.1 Cc1ccc(cn1)OCCO 34a_100000745506_100000211926 [0,2,0,0,0,0|1,1,0]=4 2684 B11R1.1 Cc1ccc(cn1)OCCO 7a_100000745506_100000211926 [0,2,0,0,0,0|1,1,0]=4 2685 B11R1.1 Cc1ccc(cn1)SCCF 62a_100000751577_100011217306 [0,2,0,0,0,0|2,0,0]=4 2686 B11R1.1 Cc1ccc(cn1)SCCF 62a_100011217306_100000751577 [0,2,0,0,0,0|2,0,0]=4 2687 B11R1.1 Cc1ccc(cn1)SCCO 62a_100000211926_100000751577 [0,2,0,0,0,0|1,1,0]=4 2688 B11R1.1 Cc1ccc(cn1)SCCO 62a_100000751577_100000211926 [0,2,0,0,0,0|1,1,0]=4 2689 B11R1.1 Cc1ccc(nc1)CNCF 34a_100015187455_100015361967 [0,2,0,0,0,0|2,0,0]=4 2690 B11R1.1 Cc1ccc(nc1)COCF 34a_100012001401_100015361967 [0,2,0,0,0,0|2,0,0]=4 2691 B11R1.1 Cc1ccc(nc1)CSCF 62a_100000691093_100015361967 [0,2,0,0,0,0|2,0,0]=4 2692 B11R1.1 Cc1ccc(nc1)CSCF 62a_100015361967_100000691093 [0,2,0,0,0,0|2,0,0]=4 2693 B11R1.1 Cc1ccc(nc1)OCCF 34a_100000759353_100011217306 [0,2,0,0,0,0|2,0,0]=4 2694 B11R1.1 Cc1ccc(nc1)OCCO 34a_100000759353_100000211926 [0,2,0,0,0,0|1,1,0]=4 2695 B11R1.1 Cc1ccc(nc1)SCCF 62a_100011192072_100011217306 [0,2,0,0,0,0|2,0,0]=4 2696 B11R1.1 Cc1ccc(nc1)SCCF 62a_100011217306_100000754016 [0,2,0,0,0,0|2,0,0]=4 2697 B11R1.1 Cc1ccc(nc1)SCCO 62a_100000211926_100000754016 [0,2,0,0,0,0|1,1,0]=4 2698 B11R1.1 Cc1ccc(nc1)SCCO 62a_100011192072_100000211926 [0,2,0,0,0,0|1,1,0]=4 2699 B11R1.1 Cc1cnc(cn1)CNCF 34a_100132314150_100015361967 [0,2,0,0,0,0|1,0,0]=3 2700 B11R1.1 Cc1cnc(cn1)COCF 34a_100011273949_100015361967 [0,2,0,0,0,0|1,0,0]=3 2701 B11R1.1 Cc1cnc(cn1)CSCF 62a_100000752025_100015361967 [0,2,0,0,0,0|1,0,0]=3 2702 B11R1.1 Cc1cnc(cn1)CSCF 62a_100015361967_100000752025 [0,2,0,0,0,0|1,0,0]=3 2703 B11R1.1 Cc1cnc(cn1)NCCO 27a_100000210304_100000074397 [0,2,0,0,0,0|0,1,0]=3 2704 B11R1.1 Cc1cnc(cn1)SCC#N 62a_100011215382_100011999403 [0,2,0,0,0,0|1,0,1]=4 2705 B11R1.1 Cc1cnc(cn1)SCC#N 62a_100011999403_100011215382 [0,2,0,0,0,0|1,0,1]=4 2706 B11R1.1 Cc1cnc(cn1)SCC=O 62a_100011999403_200015260668 [0,2,0,0,0,0|0,1,1]=4 2707 B11R1.1 Cc1cnc(cn1)SCC=O 62a_200015260668_100011999403 [0,2,0,0,0,0|0,1,1]=4 2708 B11R1.1 Cc1cnc(cn1)SCCF 62a_100011217306_100011999403 [0,2,0,0,0,0|1,0,0]=3 2709 B11R1.1 Cc1cnc(cn1)SCCF 62a_100011999403_100011217306 [0,2,0,0,0,0|1,0,0]=3 2710 B11R1.1 Cc1cnc(cn1)SCCO 62a_100000211926_100011999403 [0,2,0,0,0,0|0,1,0]=3 2711 B11R1.1 Cc1cnc(cn1)SCCO 62a_100011999403_100000211926 [0,2,0,0,0,0|0,1,0]=3 2712 B11R1.1 FCCOc1ccc(cn1)Cl 34a_100011215309_100011217306 [0,2,0,0,0,0|2,0,0]=4 2713 B11R1.1 FCCOc1ccc(cn1)F 34a_100000742473_100011217306 [0,2,0,0,0,0|2,0,0]=4 2714 B11R1.1 FCCOc1ccc(nc1)Br 34a_100000685995_100011217306 [0,2,0,0,0,0|2,0,0]=4 2715 B11R1.1 FCCOc1ccc(nc1)Br 7a_100000685995_100011217306 [0,2,0,0,0,0|2,0,0]=4 2716 B11R1.1 FCCOc1ccc(nc1)Cl 34a_100000744096_100011217306 [0,2,0,0,0,0|2,0,0]=4 2717 B11R1.1 FCCOc1ccc(nc1)Cl 7a_100000744096_100011217306 [0,2,0,0,0,0|2,0,0]=4 2718 B11R1.1 FCCOc1ccc(nc1)F 34a_100000688820_100011217306 [0,2,0,0,0,0|2,0,0]=4 2719 B11R1.1 FCCOc1ccc(nc1)F 7a_100000688820_100011217306 [0,2,0,0,0,0|2,0,0]=4 2720 B11R1.1 FCCOc1ccc(nc1)I 34a_100000687607_100011217306 [0,2,0,0,0,0|2,0,0]=4 2721 B11R1.1 FCCOc1ccc(nc1)I 7a_100000687607_100011217306 [0,2,0,0,0,0|2,0,0]=4 2722 B11R1.1 FCCOc1cnc(cn1)Br 34a_100011934580_100011217306 [0,2,0,0,0,0|1,0,0]=3 2723 B11R1.1 FCCOc1cnc(cn1)Cl 34a_100015839800_100011217306 [0,2,0,0,0,0|1,0,0]=3 2724 B11R1.1 FCCSc1ccc(cn1)Br 62a_100000686858_100011217306 [0,2,0,0,0,0|2,0,0]=4 2725 B11R1.1 FCCSc1ccc(cn1)Br 62a_100011217306_100000686858 [0,2,0,0,0,0|2,0,0]=4 2726 B11R1.1 FCCSc1ccc(cn1)Cl 62a_100011217306_100011356976 [0,2,0,0,0,0|2,0,0]=4 2727 B11R1.1 FCCSc1ccc(cn1)Cl 62a_100011356976_100011217306 [0,2,0,0,0,0|2,0,0]=4 2728 B11R1.1 FCCSc1ccc(cn1)F 62a_100000744514_100011217306 [0,2,0,0,0,0|2,0,0]=4 2729 B11R1.1 FCCSc1ccc(cn1)F 62a_100011217306_100000744514 [0,2,0,0,0,0|2,0,0]=4 2730 B11R1.1 FCCSc1ccc(nc1)Br 62a_100009814638_100011217306 [0,2,0,0,0,0|2,0,0]=4 2731 B11R1.1 FCCSc1ccc(nc1)Br 62a_100011217306_100009814638 [0,2,0,0,0,0|2,0,0]=4 2732 B11R1.1 FCCSc1ccc(nc1)Cl 62a_100000034144_100011217306 [0,2,0,0,0,0|2,0,0]=4 2733 B11R1.1 FCCSc1ccc(nc1)Cl 62a_100011217306_100000034144 [0,2,0,0,0,0|2,0,0]=4 2734 B11R1.1 FCCSc1ccc(nc1)F 62a_100000042367_100011217306 [0,2,0,0,0,0|2,0,0]=4 2735 B11R1.1 FCCSc1ccc(nc1)F 62a_100011217306_100000042367 [0,2,0,0,0,0|2,0,0]=4 2736 B11R1.1 FCCSc1cnc(cn1)Br 62a_100010187541_100011217306 [0,2,0,0,0,0|1,0,0]=3 2737 B11R1.1 FCCSc1cnc(cn1)Br 62a_100011217306_100010187541 [0,2,0,0,0,0|1,0,0]=3 2738 B11R1.1 FCCSc1cnc(cn1)Cl 62a_100010214907_100011217306 [0,2,0,0,0,0|1,0,0]=3 2739 B11R1.1 FCCSc1cnc(cn1)Cl 62a_100011217306_100010214907 [0,2,0,0,0,0|1,0,0]=3 2740 B11R1.1 FCCSc1cnc(cn1)F 62a_100009856528_100011217306 [0,2,0,0,0,0|1,0,0]=3 2741 B11R1.1 FCCSc1cnc(cn1)F 62a_100011217306_100009856528 [0,2,0,0,0,0|1,0,0]=3 2742 B11R1.1 FCNCc1ccc(cn1)Br 34a_100015188789_100015361967 [0,2,0,0,0,0|2,0,0]=4 2743 B11R1.1 FCNCc1ccc(cn1)Cl 34a_100000697193_100015361967 [0,2,0,0,0,0|2,0,0]=4 2744 B11R1.1 FCNCc1ccc(cn1)F 34a_100020620131_100015361967 [0,2,0,0,0,0|2,0,0]=4 2745 B11R1.1 FCNCc1ccc(nc1)Br 34a_100009817727_100015361967 [0,2,0,0,0,0|2,0,0]=4 2746 B11R1.1 FCNCc1ccc(nc1)Cl 34a_100000735879_100015361967 [0,2,0,0,0,0|2,0,0]=4 2747 B11R1.1 FCNCc1ccc(nc1)F 34a_100000101913_100015361967 [0,2,0,0,0,0|2,0,0]=4 2748 B11R1.1 FCOCc1ccc(cn1)Br 34a_100000754261_100015361967 [0,2,0,0,0,0|2,0,0]=4 2749 B11R1.1 FCOCc1ccc(cn1)Cl 34a_100000703999_100015361967 [0,2,0,0,0,0|2,0,0]=4 2750 B11R1.1 FCOCc1ccc(cn1)F 34a_100011999454_100015361967 [0,2,0,0,0,0|2,0,0]=4 2751 B11R1.1 FCOCc1ccc(nc1)Br 34a_100009816760_100015361967 [0,2,0,0,0,0|2,0,0]=4 2752 B11R1.1 FCOCc1ccc(nc1)Br 7a_100009816760_100015361967 [0,2,0,0,0,0|2,0,0]=4 2753 B11R1.1 FCOCc1ccc(nc1)Cl 34a_100000755211_100015361967 [0,2,0,0,0,0|2,0,0]=4 2754 B11R1.1 FCOCc1ccc(nc1)Cl 7a_100000755211_100015361967 [0,2,0,0,0,0|2,0,0]=4 2755 B11R1.1 FCOCc1ccc(nc1)F 34a_100000079959_100015361967 [0,2,0,0,0,0|2,0,0]=4 2756 B11R1.1 FCOCc1cnc(cn1)Cl 34a_100012002382_100015361967 [0,2,0,0,0,0|1,0,0]=3 2757 B11R1.1 FCSCc1ccc(cn1)Br 62a_100000702658_100015361967 [0,2,0,0,0,0|2,0,0]=4 2758 B11R1.1 FCSCc1ccc(cn1)Br 62a_100015361967_100000702658 [0,2,0,0,0,0|2,0,0]=4 2759 B11R1.1 FCSCc1ccc(cn1)Cl 62a_100012066911_100015361967 [0,2,0,0,0,0|2,0,0]=4 2760 B11R1.1 FCSCc1ccc(cn1)Cl 62a_100015361967_100000697101 [0,2,0,0,0,0|2,0,0]=4 2761 B11R1.1 FCSCc1ccc(cn1)F 62a_100000703193_100015361967 [0,2,0,0,0,0|2,0,0]=4 2762 B11R1.1 FCSCc1ccc(cn1)F 62a_100015361967_100000703193 [0,2,0,0,0,0|2,0,0]=4 2763 B11R1.1 FCSCc1ccc(nc1)Br 62a_100009831999_100015361967 [0,2,0,0,0,0|2,0,0]=4 2764 B11R1.1 FCSCc1ccc(nc1)Br 62a_100015361967_100009831999 [0,2,0,0,0,0|2,0,0]=4 2765 B11R1.1 FCSCc1ccc(nc1)Cl 62a_100000735431_100015361967 [0,2,0,0,0,0|2,0,0]=4 2766 B11R1.1 FCSCc1ccc(nc1)Cl 62a_100015361967_100000735431 [0,2,0,0,0,0|2,0,0]=4 2767 B11R1.1 FCSCc1ccc(nc1)F 62a_100009820150_100015361967 [0,2,0,0,0,0|2,0,0]=4 2768 B11R1.1 FCSCc1ccc(nc1)F 62a_100015361967_100000099788 [0,2,0,0,0,0|2,0,0]=4 2769 B11R1.1 N#CCSc1cnc(cn1)Br 62a_100010187541_100011215382 [0,2,0,0,0,0|1,0,1]=4 2770 B11R1.1 N#CCSc1cnc(cn1)Br 62a_100011215382_100010187541 [0,2,0,0,0,0|1,0,1]=4 2771 B11R1.1 N#CCSc1cnc(cn1)Cl 62a_100010214907_100011215382 [0,2,0,0,0,0|1,0,1]=4 2772 B11R1.1 N#CCSc1cnc(cn1)Cl 62a_100011215382_100010214907 [0,2,0,0,0,0|1,0,1]=4 2773 B11R1.1 N#CCSc1cnc(cn1)F 62a_100009856528_100011215382 [0,2,0,0,0,0|1,0,1]=4 2774 B11R1.1 N#CCSc1cnc(cn1)F 62a_100011215382_100009856528 [0,2,0,0,0,0|1,0,1]=4 2775 B11R1.1 N#CCSc1cnc(cn1)N 62a_100000744751_100011215382 [0,2,0,0,0,0|1,0,1]=4 2776 B11R1.1 N#CCSc1cnc(cn1)N 62a_100011215382_100000744751 [0,2,0,0,0,0|1,0,1]=4 2777 B11R1.1 N#CCSc1cnc(cn1)O 62a_100011215382_100015839800 [0,2,0,0,0,0|1,0,1]=4 2778 B11R1.1 N#CCSc1cnc(cn1)O 62a_100011934580_100011215382 [0,2,0,0,0,0|1,0,1]=4 2779 B11R1.1 NCCNc1ccc(cn1)O 271570a_203496583355_200011214600 [0,2,0,0,0,0|2,0,0]=4 2780 B11R1.1 Nc1ccc(cn1)COCF 34a_100000704267_100015361967 [0,2,0,0,0,0|2,0,0]=4 2781 B11R1.1 Nc1ccc(cn1)OCCF 34a_100015188713_100011217306 [0,2,0,0,0,0|2,0,0]=4 2782 B11R1.1 Nc1ccc(cn1)OCCF 7a_100015188713_100011217306 [0,2,0,0,0,0|2,0,0]=4 2783 B11R1.1 Nc1ccc(cn1)OCCO 34a_100015188713_100000211926 [0,2,0,0,0,0|1,1,0]=4 2784 B11R1.1 Nc1ccc(cn1)OCCO 7a_100015188713_100000211926 [0,2,0,0,0,0|1,1,0]=4 2785 B11R1.1 Nc1ccc(cn1)SCCF 62a_100000187370_100011217306 [0,2,0,0,0,0|2,0,0]=4 2786 B11R1.1 Nc1ccc(cn1)SCCF 62a_100011217306_100000187370 [0,2,0,0,0,0|2,0,0]=4 2787 B11R1.1 Nc1ccc(cn1)SCCO 62a_100000187370_100000211926 [0,2,0,0,0,0|1,1,0]=4 2788 B11R1.1 Nc1ccc(cn1)SCCO 62a_100000211926_100000187370 [0,2,0,0,0,0|1,1,0]=4 2789 B11R1.1 Nc1ccc(nc1)COCF 34a_100011998161_100015361967 [0,2,0,0,0,0|2,0,0]=4 2790 B11R1.1 Nc1ccc(nc1)OCCF 34a_100000729260_100011217306 [0,2,0,0,0,0|2,0,0]=4 2791 B11R1.1 Nc1ccc(nc1)OCCO 34a_100000729260_100000211926 [0,2,0,0,0,0|1,1,0]=4 2792 B11R1.1 Nc1ccc(nc1)SCCF 62a_100000737798_100011217306 [0,2,0,0,0,0|2,0,0]=4 2793 B11R1.1 Nc1ccc(nc1)SCCF 62a_100011217306_100000737798 [0,2,0,0,0,0|2,0,0]=4 2794 B11R1.1 Nc1ccc(nc1)SCCO 62a_100000211926_100000737798 [0,2,0,0,0,0|1,1,0]=4 2795 B11R1.1 Nc1ccc(nc1)SCCO 62a_100000737798_100000211926 [0,2,0,0,0,0|1,1,0]=4 2796 B11R1.1 Nc1cnc(cn1)SCC=O 62a_100000744751_200015260668 [0,2,0,0,0,0|0,1,1]=4 2797 B11R1.1 Nc1cnc(cn1)SCC=O 62a_200015260668_100000744751 [0,2,0,0,0,0|0,1,1]=4 2798 B11R1.1 Nc1cnc(cn1)SCCF 62a_100000744751_100011217306 [0,2,0,0,0,0|1,0,0]=3 2799 B11R1.1 Nc1cnc(cn1)SCCF 62a_100011217306_100000744751 [0,2,0,0,0,0|1,0,0]=3 2800 B11R1.1 Nc1cnc(cn1)SCCO 62a_100000211926_100000744751 [0,2,0,0,0,0|0,1,0]=3 2801 B11R1.1 Nc1cnc(cn1)SCCO 62a_100000744751_100000211926 [0,2,0,0,0,0|0,1,0]=3 2802 B11R1.1 Nc1ncc(nn1)NCCO 27a_100000210304_100000691435 [0,2,0,0,0,0|1,1,0]=4 2803 B11R1.1 Nc1ncc(nn1)SCCF 62a_100000691435_100011217306 [0,2,0,0,0,0|2,0,0]=4 2804 B11R1.1 Nc1ncc(nn1)SCCF 62a_100011217306_100000691435 [0,2,0,0,0,0|2,0,0]=4 2805 B11R1.1 Nc1ncc(nn1)SCCO 62a_100000211926_100000691435 [0,2,0,0,0,0|1,1,0]=4 2806 B11R1.1 Nc1ncc(nn1)SCCO 62a_100000691435_100000211926 [0,2,0,0,0,0|1,1,0]=4 2807 B11R1.1 O=CCOc1cnc(cn1)Br 34a_100011934580_200009817547 [0,2,0,0,0,0|0,1,1]=4 2808 B11R1.1 O=CCOc1cnc(cn1)Cl 34a_100015839800_200009817547 [0,2,0,0,0,0|0,1,1]=4 2809 B11R1.1 O=CCSc1cnc(cn1)Br 62a_100010187541_200015260668 [0,2,0,0,0,0|0,1,1]=4 2810 B11R1.1 O=CCSc1cnc(cn1)Br 62a_200015260668_100010187541 [0,2,0,0,0,0|0,1,1]=4 2811 B11R1.1 O=CCSc1cnc(cn1)Cl 62a_100010214907_200015260668 [0,2,0,0,0,0|0,1,1]=4 2812 B11R1.1 O=CCSc1cnc(cn1)Cl 62a_200015260668_100010214907 [0,2,0,0,0,0|0,1,1]=4 2813 B11R1.1 O=CCSc1cnc(cn1)F 62a_100009856528_200015260668 [0,2,0,0,0,0|0,1,1]=4 2814 B11R1.1 O=CCSc1cnc(cn1)F 62a_200015260668_100009856528 [0,2,0,0,0,0|0,1,1]=4 2815 B11R1.1 O=CCSc1cnc(cn1)O 62a_100011934580_200015260668 [0,2,0,0,0,0|0,1,1]=4 2816 B11R1.1 O=CCSc1cnc(cn1)O 62a_200015260668_100015839800 [0,2,0,0,0,0|0,1,1]=4 2817 B11R1.1 OCCNc1ccc(cn1)Br 27a_100000210304_100000686858 [0,2,0,0,0,0|1,1,0]=4 2818 B11R1.1 OCCNc1cnc(cn1)Br 27a_100000210304_100010187541 [0,2,0,0,0,0|0,1,0]=3 2819 B11R1.1 OCCNc1cnc(cn1)F 27a_100000210304_100009856528 [0,2,0,0,0,0|0,1,0]=3 2820 B11R1.1 OCCOc1ccc(cn1)Cl 34a_100011215309_100000211926 [0,2,0,0,0,0|1,1,0]=4 2821 B11R1.1 OCCOc1ccc(cn1)F 34a_100000742473_100000211926 [0,2,0,0,0,0|1,1,0]=4 2822 B11R1.1 OCCOc1ccc(nc1)Br 34a_100000685995_100000211926 [0,2,0,0,0,0|1,1,0]=4 2823 B11R1.1 OCCOc1ccc(nc1)Br 7a_100000685995_100000211926 [0,2,0,0,0,0|1,1,0]=4 2824 B11R1.1 OCCOc1ccc(nc1)Cl 34a_100000744096_100000211926 [0,2,0,0,0,0|1,1,0]=4 2825 B11R1.1 OCCOc1ccc(nc1)Cl 7a_100000744096_100000211926 [0,2,0,0,0,0|1,1,0]=4 2826 B11R1.1 OCCOc1ccc(nc1)F 34a_100000688820_100000211926 [0,2,0,0,0,0|1,1,0]=4 2827 B11R1.1 OCCOc1ccc(nc1)F 7a_100000688820_100000211926 [0,2,0,0,0,0|1,1,0]=4 2828 B11R1.1 OCCOc1ccc(nc1)I 34a_100000687607_100000211926 [0,2,0,0,0,0|1,1,0]=4 2829 B11R1.1 OCCOc1ccc(nc1)I 7a_100000687607_100000211926 [0,2,0,0,0,0|1,1,0]=4 2830 B11R1.1 OCCOc1ccc(nc1)O 271570a_203496583355_200013150534 [0,2,0,0,0,0|1,1,0]=4 2831 B11R1.1 OCCOc1cnc(cn1)Br 34a_100011934580_100000211926 [0,2,0,0,0,0|0,1,0]=3 2832 B11R1.1 OCCOc1cnc(cn1)Cl 34a_100015839800_100000211926 [0,2,0,0,0,0|0,1,0]=3 2833 B11R1.1 OCCSc1ccc(cn1)Br 62a_100000211926_100000686858 [0,2,0,0,0,0|1,1,0]=4 2834 B11R1.1 OCCSc1ccc(cn1)Br 62a_100000686858_100000211926 [0,2,0,0,0,0|1,1,0]=4 2835 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100000211926_100011356976 [0,2,0,0,0,0|1,1,0]=4 2836 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100011356976_100000211926 [0,2,0,0,0,0|1,1,0]=4 2837 B11R1.1 OCCSc1ccc(cn1)F 62a_100000211926_100000744514 [0,2,0,0,0,0|1,1,0]=4 2838 B11R1.1 OCCSc1ccc(cn1)F 62a_100000744514_100000211926 [0,2,0,0,0,0|1,1,0]=4 2839 B11R1.1 OCCSc1ccc(cn1)O 62a_100000211926_100000744096 [0,2,0,0,0,0|1,1,0]=4 2840 B11R1.1 OCCSc1ccc(cn1)O 62a_100000685995_100000211926 [0,2,0,0,0,0|1,1,0]=4 2841 B11R1.1 OCCSc1ccc(nc1)Br 62a_100000211926_100009814638 [0,2,0,0,0,0|1,1,0]=4 2842 B11R1.1 OCCSc1ccc(nc1)Br 62a_100009814638_100000211926 [0,2,0,0,0,0|1,1,0]=4 2843 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000034144_100000211926 [0,2,0,0,0,0|1,1,0]=4 2844 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000211926_100000034144 [0,2,0,0,0,0|1,1,0]=4 2845 B11R1.1 OCCSc1ccc(nc1)F 62a_100000042367_100000211926 [0,2,0,0,0,0|1,1,0]=4 2846 B11R1.1 OCCSc1ccc(nc1)F 62a_100000211926_100000042367 [0,2,0,0,0,0|1,1,0]=4 2847 B11R1.1 OCCSc1cnc(cn1)Br 62a_100000211926_100010187541 [0,2,0,0,0,0|0,1,0]=3 2848 B11R1.1 OCCSc1cnc(cn1)Br 62a_100010187541_100000211926 [0,2,0,0,0,0|0,1,0]=3 2849 B11R1.1 OCCSc1cnc(cn1)Cl 62a_100000211926_100010214907 [0,2,0,0,0,0|0,1,0]=3 2850 B11R1.1 OCCSc1cnc(cn1)Cl 62a_100010214907_100000211926 [0,2,0,0,0,0|0,1,0]=3 2851 B11R1.1 OCCSc1cnc(cn1)F 62a_100000211926_100009856528 [0,2,0,0,0,0|0,1,0]=3 2852 B11R1.1 OCCSc1cnc(cn1)F 62a_100009856528_100000211926 [0,2,0,0,0,0|0,1,0]=3 2853 B11R1.1 OCCSc1cnc(cn1)O 62a_100000211926_100015839800 [0,2,0,0,0,0|0,1,0]=3 2854 B11R1.1 OCCSc1cnc(cn1)O 62a_100011934580_100000211926 [0,2,0,0,0,0|0,1,0]=3 2855 B11R1.1 Oc1ccc(nc1)SCCF 62a_100000685995_100011217306 [0,2,0,0,0,0|2,0,0]=4 2856 B11R1.1 Oc1ccc(nc1)SCCF 62a_100011217306_100000744096 [0,2,0,0,0,0|2,0,0]=4 2857 B11R1.1 Oc1cnc(cn1)SCCF 62a_100011217306_100015839800 [0,2,0,0,0,0|1,0,0]=3 2858 B11R1.1 Oc1cnc(cn1)SCCF 62a_100011934580_100011217306 [0,2,0,0,0,0|1,0,0]=3 2859 B11R1.1 [13CH3]OCCc1ccc(cn1)Br 34a_100012357577_200025704644 [0,2,0,0,0,0|1,1,0]=4 2860 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 34a_100009880866_200025704644 [0,2,0,0,0,0|1,1,0]=4 2861 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 7a_100009880866_200025704644 [0,2,0,0,0,0|1,1,0]=4 2862 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_100011740612_200025704644 [0,2,0,0,0,0|2,0,0]=4 2863 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_200025704644_100011740612 [0,2,0,0,0,0|2,0,0]=4 2864 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_100011713675_200025704644 [0,2,0,0,0,0|2,0,0]=4 2865 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_200025704644_100011713675 [0,2,0,0,0,0|2,0,0]=4 2866 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_100011217392_200025704644 [0,2,0,0,0,0|2,0,0]=4 2867 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_200025704644_100011217392 [0,2,0,0,0,0|2,0,0]=4 2868 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [0,2,0,0,0,0|2,0,0]=4 2869 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [0,2,0,0,0,0|2,0,0]=4 2870 B11R1.20 CC(=O)Cc1cnc(cn1)C 1458a_100000070787_100000752025 [0,2,0,0,0,0|0,1,1]=4 2871 B11R1.20 CC(C)Nc1cnc(cn1)Br 27a_100138425928_100010187541 [0,2,0,0,0,0|2,0,0]=4 2872 B11R1.20 CC(C)Nc1cnc(cn1)F 27a_100138425928_100009856528 [0,2,0,0,0,0|2,0,0]=4 2873 B11R1.20 CC(C)Oc1cnc(cn1)Br 34a_100011934580_100000210206 [0,2,0,0,0,0|2,0,0]=4 2874 B11R1.20 CC(C)Oc1cnc(cn1)Cl 34a_100015839800_100000210206 [0,2,0,0,0,0|2,0,0]=4 2875 B11R1.20 CC(C)Oc1cnc(cn1)O 271570a_203496583355_200010967586 [0,2,0,0,0,0|2,0,0]=4 2876 B11R1.20 CC(C)Sc1cnc(cn1)Br 62a_100000210206_100010187541 [0,2,0,0,0,0|2,0,0]=4 2877 B11R1.20 CC(C)Sc1cnc(cn1)Br 62a_100010187541_100000210206 [0,2,0,0,0,0|2,0,0]=4 2878 B11R1.20 CC(C)Sc1cnc(cn1)Cl 62a_100000210206_100010214907 [0,2,0,0,0,0|2,0,0]=4 2879 B11R1.20 CC(C)Sc1cnc(cn1)Cl 62a_100010214907_100000210206 [0,2,0,0,0,0|2,0,0]=4 2880 B11R1.20 CC(C)Sc1cnc(cn1)F 62a_100000210206_100009856528 [0,2,0,0,0,0|2,0,0]=4 2881 B11R1.20 CC(C)Sc1cnc(cn1)F 62a_100009856528_100000210206 [0,2,0,0,0,0|2,0,0]=4 2882 B11R1.20 CC(C)Sc1cnc(cn1)N 62a_100000210206_100000744751 [0,2,0,0,0,0|2,0,0]=4 2883 B11R1.20 CC(C)Sc1cnc(cn1)N 62a_100000744751_100000210206 [0,2,0,0,0,0|2,0,0]=4 2884 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100000210206_100015839800 [0,2,0,0,0,0|2,0,0]=4 2885 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100011934580_100000210206 [0,2,0,0,0,0|2,0,0]=4 2886 B11R1.20 CN(C)Cc1cnc(cn1)Cl 270004a_100102631434_100012001714 [0,2,0,0,0,0|2,0,0]=4 2887 B11R1.20 Cc1cnc(cn1)CN(C)C 2230a_100102631434_100000752025 [0,2,0,0,0,0|2,0,0]=4 2888 B11R1.20 Cc1cnc(cn1)CN(C)C 269982a_100102631434_100000752025 [0,2,0,0,0,0|2,0,0]=4 2889 B11R1.20 Cc1cnc(cn1)CN(C)C 270004a_100102631434_100000685221 [0,2,0,0,0,0|2,0,0]=4 2890 B11R1.20 Cc1cnc(cn1)NC(C)C 27a_100138425928_100000074397 [0,2,0,0,0,0|2,0,0]=4 2891 B11R1.20 Cc1cnc(cn1)SC(C)C 62a_100000210206_100011999403 [0,2,0,0,0,0|2,0,0]=4 2892 B11R1.20 Cc1cnc(cn1)SC(C)C 62a_100011999403_100000210206 [0,2,0,0,0,0|2,0,0]=4 2893 B11R1.22 CNC(C)c1cnc(cn1)Cl 269862a_106832991636_100009883172 [0,2,0,0,0,0|2,0,0]=4 2894 B11R1.22 CNC(C)c1cnc(cn1)Cl 270004a_106832991635_100009883172 [0,2,0,0,0,0|2,0,0]=4 2895 B11R1.81 CCOc1ncc(nc1Cl)Br 34a_100010734560_100000210202 [0,2,0,0,0,0|2,0,0]=4 2896 B11R1.81 CCSc1ncc(nc1Br)Br 62a_100000210202_100010235571 [0,2,0,0,0,0|2,0,0]=4 2897 B11R1.81 CCSc1ncc(nc1Br)Br 62a_100010235571_100000210202 [0,2,0,0,0,0|2,0,0]=4 2898 B11R1.81 CCSc1ncc(nc1C)C 62a_100000065684_100000210202 [0,2,0,0,0,0|2,0,0]=4 2899 B11R1.81 CCSc1ncc(nc1C)C 62a_100000210202_100000065684 [0,2,0,0,0,0|2,0,0]=4 2900 B11R1.81 CCSc1ncc(nc1C)N 62a_100000210202_100009818570 [0,2,0,0,0,0|2,0,0]=4 2901 B11R1.81 CCSc1ncc(nc1C)N 62a_100009818570_100000210202 [0,2,0,0,0,0|2,0,0]=4 2902 B11R1.81 CCSc1ncc(nc1Cl)Cl 62a_100000210202_100010173851 [0,2,0,0,0,0|2,0,0]=4 2903 B11R1.81 CCSc1ncc(nc1Cl)N 62a_100000210202_100010116657 [0,2,0,0,0,0|2,0,0]=4 2904 B11R1.81 CCSc1ncc(nc1Cl)N 62a_100010116657_100000210202 [0,2,0,0,0,0|2,0,0]=4 2905 B11R1.81 CNCc1ncc(nc1Cl)Cl 2230a_100020639390_200000210301 [0,2,0,0,0,0|2,0,0]=4 2906 B11R1.81 Cc1cnc(c(n1)C)SCF 62a_100000065684_100015361967 [0,2,0,0,0,0|2,0,0]=4 2907 B11R1.81 Cc1cnc(c(n1)C)SCF 62a_100015361967_100000065684 [0,2,0,0,0,0|2,0,0]=4 2908 B11R1.81 Cc1nc(cnc1SCF)N 62a_100009818570_100015361967 [0,2,0,0,0,0|2,0,0]=4 2909 B11R1.81 Cc1nc(cnc1SCF)N 62a_100015361967_100009818570 [0,2,0,0,0,0|2,0,0]=4 2910 B11R1.81 FCOc1ncc(nc1Cl)Br 34a_100010734560_100015361967 [0,2,0,0,0,0|2,0,0]=4 2911 B11R1.81 FCSc1ncc(nc1Br)Br 62a_100010235571_100015361967 [0,2,0,0,0,0|2,0,0]=4 2912 B11R1.81 FCSc1ncc(nc1Br)Br 62a_100015361967_100010235571 [0,2,0,0,0,0|2,0,0]=4 2913 B11R1.81 FCSc1ncc(nc1Cl)Cl 62a_100015361967_100010173851 [0,2,0,0,0,0|2,0,0]=4 2914 B11R1.81 Nc1cnc(c(n1)Cl)SCF 62a_100010116657_100015361967 [0,2,0,0,0,0|2,0,0]=4 2915 B11R1.81 Nc1cnc(c(n1)Cl)SCF 62a_100015361967_100010116657 [0,2,0,0,0,0|2,0,0]=4 2916 B11R1.81 [13CH3]NCc1ncc(nc1Cl)Cl 2230a_100020639390_200025704644 [0,2,0,0,0,0|2,0,0]=4 2917 B11R1.83 C=Cc1ccc(cn1)CCO 271570a_100011290941_100009880866 [0,2,0,0,0,0|1,1,0]=4 2918 B11R1.83 C=Cc1ccc(nc1)CCO 271570a_100011290941_100012357577 [0,2,0,0,0,0|1,1,0]=4 2919 B11R1.83 C=Cc1cnc(cn1)OCC 271570a_100011290941_200012356188 [0,2,0,0,0,0|2,0,0]=4 2920 B11R1.83 CCNc1cnc(cn1)C#N 27a_100015525214_100000059812 [0,2,0,0,0,0|2,0,0]=4 2921 B11R1.83 CCNc1cnc(cn1)C=O 27a_100015525214_100012001714 [0,2,0,0,0,0|2,0,0]=4 2922 B11R1.83 CCNc1cnc(cn1)CO 27a_100015525214_100012002382 [0,2,0,0,0,0|2,0,0]=4 2923 B11R1.83 CCNc1cnc(cn1)SC 27a_100015525214_200012356277 [0,2,0,0,0,0|2,0,0]=4 2924 B11R1.83 CCOc1cnc(cn1)SC 62a_200000210301_200012356188 [0,2,0,0,0,0|2,0,0]=4 2925 B11R1.83 CCOc1cnc(cn1)SC 62a_200012356188_200000210301 [0,2,0,0,0,0|2,0,0]=4 2926 B11R1.83 CCOc1cnc(cn1)S[13CH3] 62a_200012356188_200025704644 [0,2,0,0,0,0|2,0,0]=4 2927 B11R1.83 CCOc1cnc(cn1)S[13CH3] 62a_200025704644_200012356188 [0,2,0,0,0,0|2,0,0]=4 2928 B11R1.83 CCSc1cnc(cn1)C#N 62a_100000210202_100000059812 [0,2,0,0,0,0|2,0,0]=4 2929 B11R1.83 CCSc1cnc(cn1)C=O 62a_100000210202_100012001714 [0,2,0,0,0,0|2,0,0]=4 2930 B11R1.83 CCSc1cnc(cn1)C=O 62a_100012001714_100000210202 [0,2,0,0,0,0|2,0,0]=4 2931 B11R1.83 CCSc1cnc(cn1)CO 62a_100000210202_100012002382 [0,2,0,0,0,0|2,0,0]=4 2932 B11R1.83 CCSc1cnc(cn1)CO 62a_100012002382_100000210202 [0,2,0,0,0,0|2,0,0]=4 2933 B11R1.83 CCSc1cnc(cn1)NC 62a_100000210202_100012000640 [0,2,0,0,0,0|2,0,0]=4 2934 B11R1.83 CCSc1cnc(cn1)NC 62a_100012000640_100000210202 [0,2,0,0,0,0|2,0,0]=4 2935 B11R1.83 CCSc1cnc(cn1)NN 62a_100000121042_100000210202 [0,2,0,0,0,0|2,0,0]=4 2936 B11R1.83 CCSc1cnc(cn1)NN 62a_100000210202_100000121042 [0,2,0,0,0,0|2,0,0]=4 2937 B11R1.83 CCSc1cnc(cn1)OC 62a_100000210202_100011998698 [0,2,0,0,0,0|2,0,0]=4 2938 B11R1.83 CCSc1cnc(cn1)OC 62a_100011998698_100000210202 [0,2,0,0,0,0|2,0,0]=4 2939 B11R1.83 CCSc1cnc(cn1)SC 62a_100000210202_200012356277 [0,2,0,0,0,0|2,0,0]=4 2940 B11R1.83 CCSc1cnc(cn1)SC 62a_200012356277_100000210202 [0,2,0,0,0,0|2,0,0]=4 2941 B11R1.83 CNCc1cnc(cn1)OC 207a_100102657272_100000099869 [0,2,0,0,0,0|2,0,0]=4 2942 B11R1.83 CNCc1cnc(cn1)OC 270004a_106832991635_100000099869 [0,2,0,0,0,0|2,0,0]=4 2943 B11R1.83 CNc1cnc(cn1)SCF 62a_100012000640_100015361967 [0,2,0,0,0,0|2,0,0]=4 2944 B11R1.83 CNc1cnc(cn1)SCF 62a_100015361967_100012000640 [0,2,0,0,0,0|2,0,0]=4 2945 B11R1.83 COc1cnc(cn1)SCF 62a_100011998698_100015361967 [0,2,0,0,0,0|2,0,0]=4 2946 B11R1.83 COc1cnc(cn1)SCF 62a_100015361967_100011998698 [0,2,0,0,0,0|2,0,0]=4 2947 B11R1.83 CSc1ccc(cn1)CCO 62a_100009880866_200000210301 [0,2,0,0,0,0|1,1,0]=4 2948 B11R1.83 CSc1ccc(cn1)CCO 62a_200000210301_100009880866 [0,2,0,0,0,0|1,1,0]=4 2949 B11R1.83 CSc1ccc(nc1)CCO 62a_100012357577_200000210301 [0,2,0,0,0,0|1,1,0]=4 2950 B11R1.83 CSc1ccc(nc1)CCO 62a_200000210301_100012357577 [0,2,0,0,0,0|1,1,0]=4 2951 B11R1.83 CSc1cnc(cn1)SCF 62a_100015361967_200012356277 [0,2,0,0,0,0|2,0,0]=4 2952 B11R1.83 CSc1cnc(cn1)SCF 62a_200012356277_100015361967 [0,2,0,0,0,0|2,0,0]=4 2953 B11R1.83 N#Cc1cnc(cn1)SCF 62a_100015361967_100000059812 [0,2,0,0,0,0|2,0,0]=4 2954 B11R1.83 NNc1cnc(cn1)SCF 62a_100000121042_100015361967 [0,2,0,0,0,0|2,0,0]=4 2955 B11R1.83 NNc1cnc(cn1)SCF 62a_100015361967_100000121042 [0,2,0,0,0,0|2,0,0]=4 2956 B11R1.83 O=Cc1cnc(cn1)SCF 62a_100012001714_100015361967 [0,2,0,0,0,0|2,0,0]=4 2957 B11R1.83 O=Cc1cnc(cn1)SCF 62a_100015361967_100012001714 [0,2,0,0,0,0|2,0,0]=4 2958 B11R1.83 OCc1cnc(cn1)SCF 62a_100012002382_100015361967 [0,2,0,0,0,0|2,0,0]=4 2959 B11R1.83 OCc1cnc(cn1)SCF 62a_100015361967_100012002382 [0,2,0,0,0,0|2,0,0]=4 2960 B11R1.83 [13CH3]Sc1ccc(cn1)CCO 62a_100009880866_200025704644 [0,2,0,0,0,0|1,1,0]=4 2961 B11R1.83 [13CH3]Sc1ccc(cn1)CCO 62a_200025704644_100009880866 [0,2,0,0,0,0|1,1,0]=4 2962 B11R1.83 [13CH3]Sc1ccc(nc1)CCO 62a_100012357577_200025704644 [0,2,0,0,0,0|1,1,0]=4 2963 B11R1.83 [13CH3]Sc1ccc(nc1)CCO 62a_200025704644_100012357577 [0,2,0,0,0,0|1,1,0]=4 2964 B11R1.192 CCNc1cnc(c(n1)C)C 27a_100015525214_100009878948 [0,2,0,0,0,0|2,0,0]=4 2965 B11R1.192 CCOc1cnc(c(n1)C)C 34a_200000700380_100000210202 [0,2,0,0,0,0|2,0,0]=4 2966 B11R1.192 CCOc1cnc(c(n1)Cl)Br 34a_100010080449_100000210202 [0,2,0,0,0,0|2,0,0]=4 2967 B11R1.192 CCSc1cnc(c(n1)Br)N 62a_100000210202_100010982571 [0,2,0,0,0,0|2,0,0]=4 2968 B11R1.192 CCSc1cnc(c(n1)Br)N 62a_100010982571_100000210202 [0,2,0,0,0,0|2,0,0]=4 2969 B11R1.192 CCSc1cnc(c(n1)C)C 62a_100000210202_100009878948 [0,2,0,0,0,0|2,0,0]=4 2970 B11R1.192 CCSc1cnc(c(n1)C)C 62a_100009878948_100000210202 [0,2,0,0,0,0|2,0,0]=4 2971 B11R1.192 CCSc1cnc(c(n1)C)N 62a_100000210202_100009818571 [0,2,0,0,0,0|2,0,0]=4 2972 B11R1.192 CCSc1cnc(c(n1)C)N 62a_100009818571_100000210202 [0,2,0,0,0,0|2,0,0]=4 2973 B11R1.192 CCSc1cnc(c(n1)Cl)N 62a_100000210202_100010733632 [0,2,0,0,0,0|2,0,0]=4 2974 B11R1.192 CCSc1cnc(c(n1)Cl)N 62a_100010733632_100000210202 [0,2,0,0,0,0|2,0,0]=4 2975 B11R1.192 CCSc1cnc(c(n1)N)N 62a_100000210202_100009816827 [0,2,0,0,0,0|2,0,0]=4 2976 B11R1.192 CCSc1cnc(c(n1)N)N 62a_100009816827_100000210202 [0,2,0,0,0,0|2,0,0]=4 2977 B11R1.192 Cc1nc(cnc1N)SCF 62a_100009818571_100015361967 [0,2,0,0,0,0|2,0,0]=4 2978 B11R1.192 Cc1nc(cnc1N)SCF 62a_100015361967_100009818571 [0,2,0,0,0,0|2,0,0]=4 2979 B11R1.192 Cc1ncc(nc1C)OCF 34a_200000700380_100015361967 [0,2,0,0,0,0|2,0,0]=4 2980 B11R1.192 Cc1ncc(nc1C)SCF 62a_100009878948_100015361967 [0,2,0,0,0,0|2,0,0]=4 2981 B11R1.192 Cc1ncc(nc1C)SCF 62a_100015361967_100009878948 [0,2,0,0,0,0|2,0,0]=4 2982 B11R1.192 FCOc1cnc(c(n1)Cl)Br 34a_100010080449_100015361967 [0,2,0,0,0,0|2,0,0]=4 2983 B11R1.192 Nc1ncc(nc1Br)SCF 62a_100010982571_100015361967 [0,2,0,0,0,0|2,0,0]=4 2984 B11R1.192 Nc1ncc(nc1Br)SCF 62a_100015361967_100010982571 [0,2,0,0,0,0|2,0,0]=4 2985 B11R1.192 Nc1ncc(nc1Cl)SCF 62a_100010733632_100015361967 [0,2,0,0,0,0|2,0,0]=4 2986 B11R1.192 Nc1ncc(nc1Cl)SCF 62a_100015361967_100010733632 [0,2,0,0,0,0|2,0,0]=4 2987 B11R1.192 Nc1ncc(nc1N)SCF 62a_100009816827_100015361967 [0,2,0,0,0,0|2,0,0]=4 2988 B11R1.192 Nc1ncc(nc1N)SCF 62a_100015361967_100009816827 [0,2,0,0,0,0|2,0,0]=4 2989 B11R1.17 C#CCNc1nccnc1C 27a_100000212058_100011999405 [0,2,0,0,0,0|1,0,1]=4 2990 B11R1.17 C#CCNc1nccnc1F 27a_100000212058_200010125657 [0,2,0,0,0,0|1,0,1]=4 2991 B11R1.17 C#CCOc1nccnc1C 34a_100000766352_100000184674 [0,2,0,0,0,0|1,0,1]=4 2992 B11R1.17 C#CCSc1nccnc1C 62a_100000038162_100011999405 [0,2,0,0,0,0|1,0,1]=4 2993 B11R1.17 C#CCSc1nccnc1Cl 62a_100000038162_100010886584 [0,2,0,0,0,0|1,0,1]=4 2994 B11R1.17 C#CCSc1nccnc1F 62a_100000038162_200010125657 [0,2,0,0,0,0|1,0,1]=4 2995 B11R1.17 C#CCSc1nccnc1N 62a_100000038162_100000747729 [0,2,0,0,0,0|1,0,1]=4 2996 B11R1.17 C=CCNc1nccnc1C 27a_100020586998_100011999405 [0,2,0,0,0,0|1,0,1]=4 2997 B11R1.17 C=CCNc1nccnc1F 27a_100020586998_200010125657 [0,2,0,0,0,0|1,0,1]=4 2998 B11R1.17 C=CCOc1nccnc1C 34a_100000766352_100015514636 [0,2,0,0,0,0|1,0,1]=4 2999 B11R1.17 C=CCSc1nccnc1C 62a_100000210623_100011999405 [0,2,0,0,0,0|1,0,1]=4 3000 B11R1.17 C=CCSc1nccnc1C 62a_100011999405_100000210623 [0,2,0,0,0,0|1,0,1]=4 3001 B11R1.17 C=CCSc1nccnc1Cl 62a_100000210623_100010886584 [0,2,0,0,0,0|1,0,1]=4 3002 B11R1.17 C=CCSc1nccnc1Cl 62a_100010886584_100000210623 [0,2,0,0,0,0|1,0,1]=4 3003 B11R1.17 C=CCSc1nccnc1F 62a_100000210623_200010125657 [0,2,0,0,0,0|1,0,1]=4 3004 B11R1.17 C=CCSc1nccnc1F 62a_200010125657_100000210623 [0,2,0,0,0,0|1,0,1]=4 3005 B11R1.17 C=CCSc1nccnc1N 62a_100000210623_100000747729 [0,2,0,0,0,0|1,0,1]=4 3006 B11R1.17 C=CCSc1nccnc1N 62a_100000747729_100000210623 [0,2,0,0,0,0|1,0,1]=4 3007 B11R1.17 CCCCc1cccnc1Br 271570a_100020621405_100010202626 [0,2,0,0,0,0|2,0,0]=4 3008 B11R1.17 CCCCc1cccnc1C 271570a_100020621405_100000751574 [0,2,0,0,0,0|2,0,0]=4 3009 B11R1.17 CCCCc1cccnc1Cl 271570a_100020621405_100000036424 [0,2,0,0,0,0|2,0,0]=4 3010 B11R1.17 CCCCc1cccnc1F 271570a_100020621405_100009816115 [0,2,0,0,0,0|2,0,0]=4 3011 B11R1.17 CCCCc1cccnc1N 271570a_100020621405_100000045569 [0,2,0,0,0,0|2,0,0]=4 3012 B11R1.17 CCCCc1cnccc1Br 271570a_100020621405_100010138639 [0,2,0,0,0,0|2,0,0]=4 3013 B11R1.17 CCCCc1cnccc1C 271570a_100020621405_100000761580 [0,2,0,0,0,0|2,0,0]=4 3014 B11R1.17 CCCCc1cnccc1Cl 271570a_100020621405_100009995489 [0,2,0,0,0,0|2,0,0]=4 3015 B11R1.17 CCCCc1cnccc1F 271570a_100020621405_100009820683 [0,2,0,0,0,0|2,0,0]=4 3016 B11R1.17 CCCCc1cnccc1N 271570a_100020621405_100000047001 [0,2,0,0,0,0|2,0,0]=4 3017 B11R1.17 CCCCc1ncc[nH]c1=O 271570a_100020621405_100000763361 [0,2,0,0,0,0|1,0,1]=4 3018 B11R1.17 CCCCc1ncccc1Br 271570a_100020621405_100000696092 [0,2,0,0,0,0|2,0,0]=4 3019 B11R1.17 CCCCc1ncccc1C 271570a_100020621405_100000751373 [0,2,0,0,0,0|2,0,0]=4 3020 B11R1.17 CCCCc1ncccc1Cl 271570a_100020621405_100011356963 [0,2,0,0,0,0|2,0,0]=4 3021 B11R1.17 CCCCc1ncccc1F 271570a_100020621405_100000685392 [0,2,0,0,0,0|2,0,0]=4 3022 B11R1.17 CCCCc1ncccc1N 271570a_100020621405_100000688686 [0,2,0,0,0,0|2,0,0]=4 3023 B11R1.17 CCCCc1ncccc1O 271570a_100020621405_100000034122 [0,2,0,0,0,0|2,0,0]=4 3024 B11R1.17 CCCCc1nccnc1C 271570a_100020621405_100011999405 [0,2,0,0,0,0|1,0,0]=3 3025 B11R1.17 CCCCc1nccnc1F 271570a_100020621405_200010125657 [0,2,0,0,0,0|1,0,0]=3 3026 B11R1.17 CCCCc1nccnc1N 271570a_100020621405_100000747729 [0,2,0,0,0,0|1,0,0]=3 3027 B11R1.17 CCCOc1cccnc1Br 34a_100000744436_100000210303 [0,2,0,0,0,0|2,0,0]=4 3028 B11R1.17 CCCOc1cccnc1Br 7a_100000744436_100000210303 [0,2,0,0,0,0|2,0,0]=4 3029 B11R1.17 CCCOc1cccnc1C 34a_100000745507_100000210303 [0,2,0,0,0,0|2,0,0]=4 3030 B11R1.17 CCCOc1cccnc1C 7a_100000745507_100000210303 [0,2,0,0,0,0|2,0,0]=4 3031 B11R1.17 CCCOc1cccnc1Cl 34a_100000757616_100000210303 [0,2,0,0,0,0|2,0,0]=4 3032 B11R1.17 CCCOc1cccnc1Cl 7a_100000757616_100000210303 [0,2,0,0,0,0|2,0,0]=4 3033 B11R1.17 CCCOc1cccnc1F 34a_100000061740_100000210303 [0,2,0,0,0,0|2,0,0]=4 3034 B11R1.17 CCCOc1cccnc1F 7a_100000061740_100000210303 [0,2,0,0,0,0|2,0,0]=4 3035 B11R1.17 CCCOc1cccnc1I 34a_100000034122_100000210303 [0,2,0,0,0,0|2,0,0]=4 3036 B11R1.17 CCCOc1cccnc1I 7a_100000034122_100000210303 [0,2,0,0,0,0|2,0,0]=4 3037 B11R1.17 CCCOc1cccnc1N 34a_100000211975_100000210303 [0,2,0,0,0,0|2,0,0]=4 3038 B11R1.17 CCCOc1cccnc1N 7a_100000211975_100000210303 [0,2,0,0,0,0|2,0,0]=4 3039 B11R1.17 CCCOc1cnccc1C 34a_100011997053_100000210303 [0,2,0,0,0,0|2,0,0]=4 3040 B11R1.17 CCCOc1cnccc1C 7a_100011997053_100000210303 [0,2,0,0,0,0|2,0,0]=4 3041 B11R1.17 CCCOc1cnccc1Cl 34a_100011996695_100000210303 [0,2,0,0,0,0|2,0,0]=4 3042 B11R1.17 CCCOc1cnccc1I 34a_100000050107_100000210303 [0,2,0,0,0,0|2,0,0]=4 3043 B11R1.17 CCCOc1cnccc1N 34a_100000753702_100000210303 [0,2,0,0,0,0|2,0,0]=4 3044 B11R1.17 CCCOc1ncccc1Cl 34a_100011290957_100000210303 [0,2,0,0,0,0|2,0,0]=4 3045 B11R1.17 CCCOc1ncccc1F 34a_100011219419_100000210303 [0,2,0,0,0,0|2,0,0]=4 3046 B11R1.17 CCCOc1ncccc1N 34a_100000746358_100000210303 [0,2,0,0,0,0|2,0,0]=4 3047 B11R1.17 CCCOc1ncccc1O 271570a_203496583355_200011465209 [0,2,0,0,0,0|2,0,0]=4 3048 B11R1.17 CCCOc1nccnc1C 34a_100000766352_100000210303 [0,2,0,0,0,0|1,0,0]=3 3049 B11R1.17 CCCSc1cccnc1Br 62a_100000210303_100010202626 [0,2,0,0,0,0|2,0,0]=4 3050 B11R1.17 CCCSc1cccnc1Br 62a_100010202626_100000210303 [0,2,0,0,0,0|2,0,0]=4 3051 B11R1.17 CCCSc1cccnc1C 62a_100000210303_100000751574 [0,2,0,0,0,0|2,0,0]=4 3052 B11R1.17 CCCSc1cccnc1C 62a_100000751574_100000210303 [0,2,0,0,0,0|2,0,0]=4 3053 B11R1.17 CCCSc1cccnc1Cl 62a_100000036424_100000210303 [0,2,0,0,0,0|2,0,0]=4 3054 B11R1.17 CCCSc1cccnc1Cl 62a_100000210303_100000036424 [0,2,0,0,0,0|2,0,0]=4 3055 B11R1.17 CCCSc1cccnc1F 62a_100000210303_100009816115 [0,2,0,0,0,0|2,0,0]=4 3056 B11R1.17 CCCSc1cccnc1F 62a_100009816115_100000210303 [0,2,0,0,0,0|2,0,0]=4 3057 B11R1.17 CCCSc1cccnc1N 62a_100000045569_100000210303 [0,2,0,0,0,0|2,0,0]=4 3058 B11R1.17 CCCSc1cccnc1N 62a_100000210303_100000045569 [0,2,0,0,0,0|2,0,0]=4 3059 B11R1.17 CCCSc1cccnc1O 62a_100000210303_100000760158 [0,2,0,0,0,0|2,0,0]=4 3060 B11R1.17 CCCSc1cccnc1O 62a_100000760158_100000210303 [0,2,0,0,0,0|2,0,0]=4 3061 B11R1.17 CCCSc1cnccc1Br 62a_100000210303_100010138639 [0,2,0,0,0,0|2,0,0]=4 3062 B11R1.17 CCCSc1cnccc1Br 62a_100010138639_100000210303 [0,2,0,0,0,0|2,0,0]=4 3063 B11R1.17 CCCSc1cnccc1C 62a_100000210303_100000761580 [0,2,0,0,0,0|2,0,0]=4 3064 B11R1.17 CCCSc1cnccc1C 62a_100000761580_100000210303 [0,2,0,0,0,0|2,0,0]=4 3065 B11R1.17 CCCSc1cnccc1Cl 62a_100000210303_100009995489 [0,2,0,0,0,0|2,0,0]=4 3066 B11R1.17 CCCSc1cnccc1Cl 62a_100009995489_100000210303 [0,2,0,0,0,0|2,0,0]=4 3067 B11R1.17 CCCSc1cnccc1F 62a_100000210303_100009820683 [0,2,0,0,0,0|2,0,0]=4 3068 B11R1.17 CCCSc1cnccc1F 62a_100009820683_100000210303 [0,2,0,0,0,0|2,0,0]=4 3069 B11R1.17 CCCSc1cnccc1N 62a_100000047001_100000210303 [0,2,0,0,0,0|2,0,0]=4 3070 B11R1.17 CCCSc1cnccc1N 62a_100000210303_100000047001 [0,2,0,0,0,0|2,0,0]=4 3071 B11R1.17 CCCSc1ncc[nH]c1=O 62a_100000210303_100000763361 [0,2,0,0,0,0|1,0,1]=4 3072 B11R1.17 CCCSc1ncccc1Br 62a_100000210303_100000696092 [0,2,0,0,0,0|2,0,0]=4 3073 B11R1.17 CCCSc1ncccc1Br 62a_100000696092_100000210303 [0,2,0,0,0,0|2,0,0]=4 3074 B11R1.17 CCCSc1ncccc1C 62a_100000210303_100000751373 [0,2,0,0,0,0|2,0,0]=4 3075 B11R1.17 CCCSc1ncccc1C 62a_100000751373_100000210303 [0,2,0,0,0,0|2,0,0]=4 3076 B11R1.17 CCCSc1ncccc1Cl 62a_100000210303_100011356963 [0,2,0,0,0,0|2,0,0]=4 3077 B11R1.17 CCCSc1ncccc1Cl 62a_100011356963_100000210303 [0,2,0,0,0,0|2,0,0]=4 3078 B11R1.17 CCCSc1ncccc1F 62a_100000210303_100000685392 [0,2,0,0,0,0|2,0,0]=4 3079 B11R1.17 CCCSc1ncccc1F 62a_100000685392_100000210303 [0,2,0,0,0,0|2,0,0]=4 3080 B11R1.17 CCCSc1ncccc1N 62a_100000210303_100000688686 [0,2,0,0,0,0|2,0,0]=4 3081 B11R1.17 CCCSc1ncccc1N 62a_100000688686_100000210303 [0,2,0,0,0,0|2,0,0]=4 3082 B11R1.17 CCCSc1ncccc1O 62a_100000034122_100000210303 [0,2,0,0,0,0|2,0,0]=4 3083 B11R1.17 CCCSc1ncccc1O 62a_100000210303_100000034122 [0,2,0,0,0,0|2,0,0]=4 3084 B11R1.17 CCCSc1nccnc1C 62a_100000210303_100011999405 [0,2,0,0,0,0|1,0,0]=3 3085 B11R1.17 CCCSc1nccnc1C 62a_100011999405_100000210303 [0,2,0,0,0,0|1,0,0]=3 3086 B11R1.17 CCCSc1nccnc1Cl 62a_100000210303_100010886584 [0,2,0,0,0,0|1,0,0]=3 3087 B11R1.17 CCCSc1nccnc1Cl 62a_100010886584_100000210303 [0,2,0,0,0,0|1,0,0]=3 3088 B11R1.17 CCCSc1nccnc1F 62a_100000210303_200010125657 [0,2,0,0,0,0|1,0,0]=3 3089 B11R1.17 CCCSc1nccnc1F 62a_200010125657_100000210303 [0,2,0,0,0,0|1,0,0]=3 3090 B11R1.17 CCCSc1nccnc1N 62a_100000210303_100000747729 [0,2,0,0,0,0|1,0,0]=3 3091 B11R1.17 CCCSc1nccnc1N 62a_100000747729_100000210303 [0,2,0,0,0,0|1,0,0]=3 3092 B11R1.17 CCNCc1cccnc1Br 2230a_100009818023_100000210202 [0,2,0,0,0,0|2,0,0]=4 3093 B11R1.17 CCNCc1cccnc1Br 2230a_100015525214_100010140945 [0,2,0,0,0,0|2,0,0]=4 3094 B11R1.17 CCNCc1cccnc1Br 34a_100009818023_100000210202 [0,2,0,0,0,0|2,0,0]=4 3095 B11R1.17 CCNCc1cccnc1C 207a_100015525214_100000751968 [0,2,0,0,0,0|2,0,0]=4 3096 B11R1.17 CCNCc1cccnc1C 2230a_100015525214_100000732876 [0,2,0,0,0,0|2,0,0]=4 3097 B11R1.17 CCNCc1cccnc1C 270004a_100015525214_100000751968 [0,2,0,0,0,0|2,0,0]=4 3098 B11R1.17 CCNCc1cccnc1Cl 2230a_100015189234_100000210202 [0,2,0,0,0,0|2,0,0]=4 3099 B11R1.17 CCNCc1cccnc1Cl 2230a_100015525214_100000045678 [0,2,0,0,0,0|2,0,0]=4 3100 B11R1.17 CCNCc1cccnc1Cl 34a_100015189234_100000210202 [0,2,0,0,0,0|2,0,0]=4 3101 B11R1.17 CCNCc1cccnc1F 2230a_100015525214_100000099810 [0,2,0,0,0,0|2,0,0]=4 3102 B11R1.17 CCNCc1cccnc1F 34a_100000724633_100000210202 [0,2,0,0,0,0|2,0,0]=4 3103 B11R1.17 CCNCc1cccnc1O 207a_100015525214_100011998315 [0,2,0,0,0,0|2,0,0]=4 3104 B11R1.17 CCNCc1cccnc1O 270004a_100015525214_100011998315 [0,2,0,0,0,0|2,0,0]=4 3105 B11R1.17 CCNCc1cnccc1Br 270004a_100015525214_100009816821 [0,2,0,0,0,0|2,0,0]=4 3106 B11R1.17 CCNCc1cnccc1C 207a_100015525214_100000685662 [0,2,0,0,0,0|2,0,0]=4 3107 B11R1.17 CCNCc1cnccc1C 2230a_100015525214_100000690890 [0,2,0,0,0,0|2,0,0]=4 3108 B11R1.17 CCNCc1cnccc1C 270004a_100015525214_100000685662 [0,2,0,0,0,0|2,0,0]=4 3109 B11R1.17 CCNCc1cnccc1Cl 270004a_100015525214_100000050567 [0,2,0,0,0,0|2,0,0]=4 3110 B11R1.17 CCNCc1ncccc1Br 207a_100015525214_100011934733 [0,2,0,0,0,0|2,0,0]=4 3111 B11R1.17 CCNCc1ncccc1Br 2230a_100015525214_100025702911 [0,2,0,0,0,0|2,0,0]=4 3112 B11R1.17 CCNCc1ncccc1Br 270004a_100015525214_100011934733 [0,2,0,0,0,0|2,0,0]=4 3113 B11R1.17 CCNCc1ncccc1C 207a_100015525214_100000698913 [0,2,0,0,0,0|2,0,0]=4 3114 B11R1.17 CCNCc1ncccc1C 2230a_100015525214_100000696600 [0,2,0,0,0,0|2,0,0]=4 3115 B11R1.17 CCNCc1ncccc1C 270004a_100015525214_100000698913 [0,2,0,0,0,0|2,0,0]=4 3116 B11R1.17 CCNCc1ncccc1C 34a_100011223789_100000210202 [0,2,0,0,0,0|2,0,0]=4 3117 B11R1.17 CCNCc1ncccc1Cl 207a_100015525214_100012001307 [0,2,0,0,0,0|2,0,0]=4 3118 B11R1.17 CCNCc1ncccc1Cl 2230a_100015189233_100000210202 [0,2,0,0,0,0|2,0,0]=4 3119 B11R1.17 CCNCc1ncccc1Cl 2230a_100015525214_100000099807 [0,2,0,0,0,0|2,0,0]=4 3120 B11R1.17 CCNCc1ncccc1Cl 270004a_100015525214_100012001307 [0,2,0,0,0,0|2,0,0]=4 3121 B11R1.17 CCNCc1ncccc1F 207a_100015525214_100011934734 [0,2,0,0,0,0|2,0,0]=4 3122 B11R1.17 CCNCc1ncccc1F 2230a_100015525214_100000104219 [0,2,0,0,0,0|2,0,0]=4 3123 B11R1.17 CCNCc1ncccc1F 270004a_100015525214_100011934734 [0,2,0,0,0,0|2,0,0]=4 3124 B11R1.17 CCNCc1ncccc1F 34a_100000690088_100000210202 [0,2,0,0,0,0|2,0,0]=4 3125 B11R1.17 CCNCc1nccnc1C 2230a_100020641712_100000210202 [0,2,0,0,0,0|1,0,0]=3 3126 B11R1.17 CCNCc1nccnc1C 270004a_100015525214_100000050726 [0,2,0,0,0,0|1,0,0]=3 3127 B11R1.17 CCNCc1nccnc1C 34a_100020641712_100000210202 [0,2,0,0,0,0|1,0,0]=3 3128 B11R1.17 CCNCc1nccnc1Cl 2230a_100000729963_100000210202 [0,2,0,0,0,0|1,0,0]=3 3129 B11R1.17 CCOCc1cccnc1Br 34a_100000719692_100000210202 [0,2,0,0,0,0|2,0,0]=4 3130 B11R1.17 CCOCc1cccnc1Br 34a_100121572206_100010140945 [0,2,0,0,0,0|2,0,0]=4 3131 B11R1.17 CCOCc1cccnc1Br 7a_100000719692_100000210202 [0,2,0,0,0,0|2,0,0]=4 3132 B11R1.17 CCOCc1cccnc1C 34a_100000729262_100000210202 [0,2,0,0,0,0|2,0,0]=4 3133 B11R1.17 CCOCc1cccnc1C 34a_100121572206_100000732876 [0,2,0,0,0,0|2,0,0]=4 3134 B11R1.17 CCOCc1cccnc1C 7a_100000729262_100000210202 [0,2,0,0,0,0|2,0,0]=4 3135 B11R1.17 CCOCc1cccnc1Cl 34a_100000748726_100000210202 [0,2,0,0,0,0|2,0,0]=4 3136 B11R1.17 CCOCc1cccnc1Cl 34a_100121572206_100000045678 [0,2,0,0,0,0|2,0,0]=4 3137 B11R1.17 CCOCc1cccnc1Cl 7a_100000748726_100000210202 [0,2,0,0,0,0|2,0,0]=4 3138 B11R1.17 CCOCc1cccnc1F 34a_100000079888_100000210202 [0,2,0,0,0,0|2,0,0]=4 3139 B11R1.17 CCOCc1cccnc1F 34a_100121572206_100000099810 [0,2,0,0,0,0|2,0,0]=4 3140 B11R1.17 CCOCc1cccnc1F 7a_100000079888_100000210202 [0,2,0,0,0,0|2,0,0]=4 3141 B11R1.17 CCOCc1cnccc1C 34a_100011996381_100000210202 [0,2,0,0,0,0|2,0,0]=4 3142 B11R1.17 CCOCc1cnccc1C 34a_100121572206_100000690890 [0,2,0,0,0,0|2,0,0]=4 3143 B11R1.17 CCOCc1cnccc1Cl 34a_100000117392_100000210202 [0,2,0,0,0,0|2,0,0]=4 3144 B11R1.17 CCOCc1ncccc1Br 34a_100011996772_100000210202 [0,2,0,0,0,0|2,0,0]=4 3145 B11R1.17 CCOCc1ncccc1Br 34a_100121572206_100025702911 [0,2,0,0,0,0|2,0,0]=4 3146 B11R1.17 CCOCc1ncccc1C 34a_100000698912_100000210202 [0,2,0,0,0,0|2,0,0]=4 3147 B11R1.17 CCOCc1ncccc1C 34a_100121572206_100000696600 [0,2,0,0,0,0|2,0,0]=4 3148 B11R1.17 CCOCc1ncccc1Cl 34a_100012002383_100000210202 [0,2,0,0,0,0|2,0,0]=4 3149 B11R1.17 CCOCc1ncccc1F 34a_100011934865_100000210202 [0,2,0,0,0,0|2,0,0]=4 3150 B11R1.17 CCOCc1ncccc1F 34a_100121572206_100000104219 [0,2,0,0,0,0|2,0,0]=4 3151 B11R1.17 CCOCc1ncccc1N 34a_114873767017_100000210202 [0,2,0,0,0,0|2,0,0]=4 3152 B11R1.17 CCOCc1ncccc1O 34a_100121572206_200020655725 [0,2,0,0,0,0|2,0,0]=4 3153 B11R1.17 CCOCc1nccnc1Cl 34a_100000057004_100000210202 [0,2,0,0,0,0|1,0,0]=3 3154 B11R1.17 CCSCc1cccnc1Br 62a_100000210202_100010140945 [0,2,0,0,0,0|2,0,0]=4 3155 B11R1.17 CCSCc1cccnc1Br 62a_100010140945_100000210202 [0,2,0,0,0,0|2,0,0]=4 3156 B11R1.17 CCSCc1cccnc1C 62a_100000210202_100000732876 [0,2,0,0,0,0|2,0,0]=4 3157 B11R1.17 CCSCc1cccnc1C 62a_100000732876_100000210202 [0,2,0,0,0,0|2,0,0]=4 3158 B11R1.17 CCSCc1cccnc1Cl 62a_100000045678_100000210202 [0,2,0,0,0,0|2,0,0]=4 3159 B11R1.17 CCSCc1cccnc1Cl 62a_100000210202_100000045678 [0,2,0,0,0,0|2,0,0]=4 3160 B11R1.17 CCSCc1cccnc1F 62a_100000099810_100000210202 [0,2,0,0,0,0|2,0,0]=4 3161 B11R1.17 CCSCc1cccnc1F 62a_100000210202_100000099810 [0,2,0,0,0,0|2,0,0]=4 3162 B11R1.17 CCSCc1cnccc1C 62a_100000210202_100000690890 [0,2,0,0,0,0|2,0,0]=4 3163 B11R1.17 CCSCc1cnccc1C 62a_100000690890_100000210202 [0,2,0,0,0,0|2,0,0]=4 3164 B11R1.17 CCSCc1ncccc1Br 62a_100000210202_100025702911 [0,2,0,0,0,0|2,0,0]=4 3165 B11R1.17 CCSCc1ncccc1Br 62a_100025702911_100000210202 [0,2,0,0,0,0|2,0,0]=4 3166 B11R1.17 CCSCc1ncccc1C 62a_100000210202_100000696600 [0,2,0,0,0,0|2,0,0]=4 3167 B11R1.17 CCSCc1ncccc1C 62a_100000696600_100000210202 [0,2,0,0,0,0|2,0,0]=4 3168 B11R1.17 CCSCc1ncccc1Cl 62a_100000099807_100000210202 [0,2,0,0,0,0|2,0,0]=4 3169 B11R1.17 CCSCc1ncccc1Cl 62a_100000210202_100000099807 [0,2,0,0,0,0|2,0,0]=4 3170 B11R1.17 CCSCc1ncccc1F 62a_100000104219_100000210202 [0,2,0,0,0,0|2,0,0]=4 3171 B11R1.17 CCSCc1ncccc1F 62a_100000210202_100000104219 [0,2,0,0,0,0|2,0,0]=4 3172 B11R1.17 CCSCc1ncccc1O 62a_100000210202_200020655725 [0,2,0,0,0,0|2,0,0]=4 3173 B11R1.17 CCSCc1ncccc1O 62a_200020655725_100000210202 [0,2,0,0,0,0|2,0,0]=4 3174 B11R1.17 COCCc1ncccc1C 34a_100011997706_200000210301 [0,2,0,0,0,0|1,1,0]=4 3175 B11R1.17 COCCc1ncccc1C 7a_100011997706_200000210301 [0,2,0,0,0,0|1,1,0]=4 3176 B11R1.17 COCSc1nccnc1C 62a_100000766300_100011999405 [0,2,0,0,0,0|1,1,0]=4 3177 B11R1.17 COCSc1nccnc1C 62a_100011999405_100000766300 [0,2,0,0,0,0|1,1,0]=4 3178 B11R1.17 COCSc1nccnc1Cl 62a_100000766300_100010886584 [0,2,0,0,0,0|1,1,0]=4 3179 B11R1.17 COCSc1nccnc1Cl 62a_100010886584_100000766300 [0,2,0,0,0,0|1,1,0]=4 3180 B11R1.17 COCSc1nccnc1F 62a_100000766300_200010125657 [0,2,0,0,0,0|1,1,0]=4 3181 B11R1.17 COCSc1nccnc1F 62a_200010125657_100000766300 [0,2,0,0,0,0|1,1,0]=4 3182 B11R1.17 COCSc1nccnc1N 62a_100000747729_100000766300 [0,2,0,0,0,0|1,1,0]=4 3183 B11R1.17 COCSc1nccnc1N 62a_100000766300_100000747729 [0,2,0,0,0,0|1,1,0]=4 3184 B11R1.17 CSCCc1ccccc1Br 62a_100012161201_200000210301 [0,2,0,0,0,0|2,0,0]=4 3185 B11R1.17 CSCCc1ccccc1Br 62a_200000210301_100012161201 [0,2,0,0,0,0|2,0,0]=4 3186 B11R1.17 CSCCc1ccccc1C 62a_100011713688_200000210301 [0,2,0,0,0,0|2,0,0]=4 3187 B11R1.17 CSCCc1ccccc1C 62a_200000210301_100011713688 [0,2,0,0,0,0|2,0,0]=4 3188 B11R1.17 CSCCc1ccccc1Cl 62a_100011713703_200000210301 [0,2,0,0,0,0|2,0,0]=4 3189 B11R1.17 CSCCc1ccccc1Cl 62a_200000210301_100011713703 [0,2,0,0,0,0|2,0,0]=4 3190 B11R1.17 CSCCc1ccccc1F 62a_100011713696_200000210301 [0,2,0,0,0,0|2,0,0]=4 3191 B11R1.17 CSCCc1ccccc1F 62a_200000210301_100011713696 [0,2,0,0,0,0|2,0,0]=4 3192 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [0,2,0,0,0,0|2,0,0]=4 3193 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [0,2,0,0,0,0|2,0,0]=4 3194 B11R1.17 CSCOc1cccnc1Br 34a_100000744436_100011218213 [0,2,0,0,0,0|2,0,0]=4 3195 B11R1.17 CSCOc1cccnc1C 34a_100000745507_100011218213 [0,2,0,0,0,0|2,0,0]=4 3196 B11R1.17 CSCOc1cccnc1Cl 34a_100000757616_100011218213 [0,2,0,0,0,0|2,0,0]=4 3197 B11R1.17 CSCOc1cccnc1F 34a_100000061740_100011218213 [0,2,0,0,0,0|2,0,0]=4 3198 B11R1.17 CSCOc1cccnc1I 34a_100000034122_100011218213 [0,2,0,0,0,0|2,0,0]=4 3199 B11R1.17 CSCOc1cccnc1N 34a_100000211975_100011218213 [0,2,0,0,0,0|2,0,0]=4 3200 B11R1.17 CSCOc1cnccc1C 34a_100011997053_100011218213 [0,2,0,0,0,0|2,0,0]=4 3201 B11R1.17 CSCOc1cnccc1Cl 34a_100011996695_100011218213 [0,2,0,0,0,0|2,0,0]=4 3202 B11R1.17 CSCOc1cnccc1I 34a_100000050107_100011218213 [0,2,0,0,0,0|2,0,0]=4 3203 B11R1.17 CSCOc1cnccc1N 34a_100000753702_100011218213 [0,2,0,0,0,0|2,0,0]=4 3204 B11R1.17 CSCOc1ncccc1Cl 34a_100011290957_100011218213 [0,2,0,0,0,0|2,0,0]=4 3205 B11R1.17 CSCOc1ncccc1F 34a_100011219419_100011218213 [0,2,0,0,0,0|2,0,0]=4 3206 B11R1.17 CSCOc1ncccc1N 34a_100000746358_100011218213 [0,2,0,0,0,0|2,0,0]=4 3207 B11R1.17 CSCOc1nccnc1C 34a_100000766352_100011218213 [0,2,0,0,0,0|1,0,0]=3 3208 B11R1.17 CSCSc1cccnc1Br 62a_100010202626_100011218213 [0,2,0,0,0,0|2,0,0]=4 3209 B11R1.17 CSCSc1cccnc1Br 62a_100011218213_100010202626 [0,2,0,0,0,0|2,0,0]=4 3210 B11R1.17 CSCSc1cccnc1C 62a_100000751574_100011218213 [0,2,0,0,0,0|2,0,0]=4 3211 B11R1.17 CSCSc1cccnc1C 62a_100011218213_100000751574 [0,2,0,0,0,0|2,0,0]=4 3212 B11R1.17 CSCSc1cccnc1Cl 62a_100000036424_100011218213 [0,2,0,0,0,0|2,0,0]=4 3213 B11R1.17 CSCSc1cccnc1Cl 62a_100011218213_100000036424 [0,2,0,0,0,0|2,0,0]=4 3214 B11R1.17 CSCSc1cccnc1F 62a_100009816115_100011218213 [0,2,0,0,0,0|2,0,0]=4 3215 B11R1.17 CSCSc1cccnc1F 62a_100011218213_100009816115 [0,2,0,0,0,0|2,0,0]=4 3216 B11R1.17 CSCSc1cccnc1N 62a_100000045569_100011218213 [0,2,0,0,0,0|2,0,0]=4 3217 B11R1.17 CSCSc1cccnc1N 62a_100011218213_100000045569 [0,2,0,0,0,0|2,0,0]=4 3218 B11R1.17 CSCSc1cccnc1O 62a_100000760158_100011218213 [0,2,0,0,0,0|2,0,0]=4 3219 B11R1.17 CSCSc1cccnc1O 62a_100011218213_100000760158 [0,2,0,0,0,0|2,0,0]=4 3220 B11R1.17 CSCSc1cnccc1Br 62a_100010138639_100011218213 [0,2,0,0,0,0|2,0,0]=4 3221 B11R1.17 CSCSc1cnccc1Br 62a_100011218213_100010138639 [0,2,0,0,0,0|2,0,0]=4 3222 B11R1.17 CSCSc1cnccc1C 62a_100000761580_100011218213 [0,2,0,0,0,0|2,0,0]=4 3223 B11R1.17 CSCSc1cnccc1C 62a_100011218213_100000761580 [0,2,0,0,0,0|2,0,0]=4 3224 B11R1.17 CSCSc1cnccc1Cl 62a_100009995489_100011218213 [0,2,0,0,0,0|2,0,0]=4 3225 B11R1.17 CSCSc1cnccc1Cl 62a_100011218213_100009995489 [0,2,0,0,0,0|2,0,0]=4 3226 B11R1.17 CSCSc1cnccc1F 62a_100009820683_100011218213 [0,2,0,0,0,0|2,0,0]=4 3227 B11R1.17 CSCSc1cnccc1F 62a_100011218213_100009820683 [0,2,0,0,0,0|2,0,0]=4 3228 B11R1.17 CSCSc1cnccc1N 62a_100000047001_100011218213 [0,2,0,0,0,0|2,0,0]=4 3229 B11R1.17 CSCSc1cnccc1N 62a_100011218213_100000047001 [0,2,0,0,0,0|2,0,0]=4 3230 B11R1.17 CSCSc1ncc[nH]c1=O 62a_100011218213_100000763361 [0,2,0,0,0,0|1,0,1]=4 3231 B11R1.17 CSCSc1ncccc1Br 62a_100000696092_100011218213 [0,2,0,0,0,0|2,0,0]=4 3232 B11R1.17 CSCSc1ncccc1Br 62a_100011218213_100000696092 [0,2,0,0,0,0|2,0,0]=4 3233 B11R1.17 CSCSc1ncccc1C 62a_100000751373_100011218213 [0,2,0,0,0,0|2,0,0]=4 3234 B11R1.17 CSCSc1ncccc1C 62a_100011218213_100000751373 [0,2,0,0,0,0|2,0,0]=4 3235 B11R1.17 CSCSc1ncccc1Cl 62a_100011218213_100011356963 [0,2,0,0,0,0|2,0,0]=4 3236 B11R1.17 CSCSc1ncccc1Cl 62a_100011356963_100011218213 [0,2,0,0,0,0|2,0,0]=4 3237 B11R1.17 CSCSc1ncccc1F 62a_100000685392_100011218213 [0,2,0,0,0,0|2,0,0]=4 3238 B11R1.17 CSCSc1ncccc1F 62a_100011218213_100000685392 [0,2,0,0,0,0|2,0,0]=4 3239 B11R1.17 CSCSc1ncccc1N 62a_100000688686_100011218213 [0,2,0,0,0,0|2,0,0]=4 3240 B11R1.17 CSCSc1ncccc1N 62a_100011218213_100000688686 [0,2,0,0,0,0|2,0,0]=4 3241 B11R1.17 CSCSc1ncccc1O 62a_100000034122_100011218213 [0,2,0,0,0,0|2,0,0]=4 3242 B11R1.17 CSCSc1ncccc1O 62a_100011218213_100000034122 [0,2,0,0,0,0|2,0,0]=4 3243 B11R1.17 CSCSc1nccnc1C 62a_100011218213_100011999405 [0,2,0,0,0,0|1,0,0]=3 3244 B11R1.17 CSCSc1nccnc1C 62a_100011999405_100011218213 [0,2,0,0,0,0|1,0,0]=3 3245 B11R1.17 CSCSc1nccnc1Cl 62a_100010886584_100011218213 [0,2,0,0,0,0|1,0,0]=3 3246 B11R1.17 CSCSc1nccnc1Cl 62a_100011218213_100010886584 [0,2,0,0,0,0|1,0,0]=3 3247 B11R1.17 CSCSc1nccnc1F 62a_100011218213_200010125657 [0,2,0,0,0,0|1,0,0]=3 3248 B11R1.17 CSCSc1nccnc1F 62a_200010125657_100011218213 [0,2,0,0,0,0|1,0,0]=3 3249 B11R1.17 CSCSc1nccnc1N 62a_100000747729_100011218213 [0,2,0,0,0,0|1,0,0]=3 3250 B11R1.17 CSCSc1nccnc1N 62a_100011218213_100000747729 [0,2,0,0,0,0|1,0,0]=3 3251 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_100011713688_200025704644 [0,2,0,0,0,0|2,0,0]=4 3252 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_200025704644_100011713688 [0,2,0,0,0,0|2,0,0]=4 3253 B11R1.17 Cc1cccnc1CCO[13CH3] 34a_100011997706_200025704644 [0,2,0,0,0,0|1,1,0]=4 3254 B11R1.17 Cc1cccnc1CCO[13CH3] 7a_100011997706_200025704644 [0,2,0,0,0,0|1,1,0]=4 3255 B11R1.17 Cc1cccnc1CNCF 34a_100011223789_100015361967 [0,2,0,0,0,0|2,0,0]=4 3256 B11R1.17 Cc1cccnc1COCF 34a_100000698912_100015361967 [0,2,0,0,0,0|2,0,0]=4 3257 B11R1.17 Cc1cccnc1CSCF 62a_100000696600_100015361967 [0,2,0,0,0,0|2,0,0]=4 3258 B11R1.17 Cc1cccnc1CSCF 62a_100015361967_100000696600 [0,2,0,0,0,0|2,0,0]=4 3259 B11R1.17 Cc1cccnc1SCCF 62a_100000751373_100011217306 [0,2,0,0,0,0|2,0,0]=4 3260 B11R1.17 Cc1cccnc1SCCF 62a_100011217306_100000751373 [0,2,0,0,0,0|2,0,0]=4 3261 B11R1.17 Cc1cccnc1SCCO 62a_100000211926_100000751373 [0,2,0,0,0,0|1,1,0]=4 3262 B11R1.17 Cc1cccnc1SCCO 62a_100000751373_100000211926 [0,2,0,0,0,0|1,1,0]=4 3263 B11R1.17 Cc1ccncc1COCF 34a_100011996381_100015361967 [0,2,0,0,0,0|2,0,0]=4 3264 B11R1.17 Cc1ccncc1CSCF 62a_100000690890_100015361967 [0,2,0,0,0,0|2,0,0]=4 3265 B11R1.17 Cc1ccncc1CSCF 62a_100015361967_100000690890 [0,2,0,0,0,0|2,0,0]=4 3266 B11R1.17 Cc1ccncc1OCCF 34a_100011997053_100011217306 [0,2,0,0,0,0|2,0,0]=4 3267 B11R1.17 Cc1ccncc1OCCF 7a_100011997053_100011217306 [0,2,0,0,0,0|2,0,0]=4 3268 B11R1.17 Cc1ccncc1OCCO 34a_100011997053_100000211926 [0,2,0,0,0,0|1,1,0]=4 3269 B11R1.17 Cc1ccncc1OCCO 7a_100011997053_100000211926 [0,2,0,0,0,0|1,1,0]=4 3270 B11R1.17 Cc1ccncc1SCCF 62a_100000761580_100011217306 [0,2,0,0,0,0|2,0,0]=4 3271 B11R1.17 Cc1ccncc1SCCF 62a_100011217306_100000761580 [0,2,0,0,0,0|2,0,0]=4 3272 B11R1.17 Cc1ccncc1SCCO 62a_100000211926_100000761580 [0,2,0,0,0,0|1,1,0]=4 3273 B11R1.17 Cc1ccncc1SCCO 62a_100000761580_100000211926 [0,2,0,0,0,0|1,1,0]=4 3274 B11R1.17 Cc1ncccc1COCF 34a_100000729262_100015361967 [0,2,0,0,0,0|2,0,0]=4 3275 B11R1.17 Cc1ncccc1COCF 7a_100000729262_100015361967 [0,2,0,0,0,0|2,0,0]=4 3276 B11R1.17 Cc1ncccc1CSCF 62a_100000732876_100015361967 [0,2,0,0,0,0|2,0,0]=4 3277 B11R1.17 Cc1ncccc1CSCF 62a_100015361967_100000732876 [0,2,0,0,0,0|2,0,0]=4 3278 B11R1.17 Cc1ncccc1OCCF 34a_100000745507_100011217306 [0,2,0,0,0,0|2,0,0]=4 3279 B11R1.17 Cc1ncccc1OCCF 7a_100000745507_100011217306 [0,2,0,0,0,0|2,0,0]=4 3280 B11R1.17 Cc1ncccc1OCCO 34a_100000745507_100000211926 [0,2,0,0,0,0|1,1,0]=4 3281 B11R1.17 Cc1ncccc1OCCO 7a_100000745507_100000211926 [0,2,0,0,0,0|1,1,0]=4 3282 B11R1.17 Cc1ncccc1SCCF 62a_100000751574_100011217306 [0,2,0,0,0,0|2,0,0]=4 3283 B11R1.17 Cc1ncccc1SCCF 62a_100011217306_100000751574 [0,2,0,0,0,0|2,0,0]=4 3284 B11R1.17 Cc1ncccc1SCCO 62a_100000211926_100000751574 [0,2,0,0,0,0|1,1,0]=4 3285 B11R1.17 Cc1ncccc1SCCO 62a_100000751574_100000211926 [0,2,0,0,0,0|1,1,0]=4 3286 B11R1.17 Cc1nccnc1CNCF 34a_100020641712_100015361967 [0,2,0,0,0,0|1,0,0]=3 3287 B11R1.17 Cc1nccnc1NCCO 27a_100000210304_100011999405 [0,2,0,0,0,0|0,1,0]=3 3288 B11R1.17 Cc1nccnc1OCC=O 34a_100000766352_200009817547 [0,2,0,0,0,0|0,1,1]=4 3289 B11R1.17 Cc1nccnc1OCCF 34a_100000766352_100011217306 [0,2,0,0,0,0|1,0,0]=3 3290 B11R1.17 Cc1nccnc1OCCO 34a_100000766352_100000211926 [0,2,0,0,0,0|0,1,0]=3 3291 B11R1.17 Cc1nccnc1SCC#N 62a_100011215382_100011999405 [0,2,0,0,0,0|1,0,1]=4 3292 B11R1.17 Cc1nccnc1SCC#N 62a_100011999405_100011215382 [0,2,0,0,0,0|1,0,1]=4 3293 B11R1.17 Cc1nccnc1SCC=O 62a_100011999405_200015260668 [0,2,0,0,0,0|0,1,1]=4 3294 B11R1.17 Cc1nccnc1SCC=O 62a_200015260668_100011999405 [0,2,0,0,0,0|0,1,1]=4 3295 B11R1.17 Cc1nccnc1SCCF 62a_100011217306_100011999405 [0,2,0,0,0,0|1,0,0]=3 3296 B11R1.17 Cc1nccnc1SCCF 62a_100011999405_100011217306 [0,2,0,0,0,0|1,0,0]=3 3297 B11R1.17 Cc1nccnc1SCCO 62a_100000211926_100011999405 [0,2,0,0,0,0|0,1,0]=3 3298 B11R1.17 Cc1nccnc1SCCO 62a_100011999405_100000211926 [0,2,0,0,0,0|0,1,0]=3 3299 B11R1.17 FCCOc1cccnc1Br 34a_100000744436_100011217306 [0,2,0,0,0,0|2,0,0]=4 3300 B11R1.17 FCCOc1cccnc1Br 7a_100000744436_100011217306 [0,2,0,0,0,0|2,0,0]=4 3301 B11R1.17 FCCOc1cccnc1Cl 34a_100000757616_100011217306 [0,2,0,0,0,0|2,0,0]=4 3302 B11R1.17 FCCOc1cccnc1Cl 7a_100000757616_100011217306 [0,2,0,0,0,0|2,0,0]=4 3303 B11R1.17 FCCOc1cccnc1F 34a_100000061740_100011217306 [0,2,0,0,0,0|2,0,0]=4 3304 B11R1.17 FCCOc1cccnc1F 7a_100000061740_100011217306 [0,2,0,0,0,0|2,0,0]=4 3305 B11R1.17 FCCOc1cccnc1I 34a_100000034122_100011217306 [0,2,0,0,0,0|2,0,0]=4 3306 B11R1.17 FCCOc1cccnc1I 7a_100000034122_100011217306 [0,2,0,0,0,0|2,0,0]=4 3307 B11R1.17 FCCOc1cnccc1Cl 34a_100011996695_100011217306 [0,2,0,0,0,0|2,0,0]=4 3308 B11R1.17 FCCOc1cnccc1I 34a_100000050107_100011217306 [0,2,0,0,0,0|2,0,0]=4 3309 B11R1.17 FCCOc1ncccc1Cl 34a_100011290957_100011217306 [0,2,0,0,0,0|2,0,0]=4 3310 B11R1.17 FCCOc1ncccc1F 34a_100011219419_100011217306 [0,2,0,0,0,0|2,0,0]=4 3311 B11R1.17 FCCSc1cccnc1Br 62a_100010202626_100011217306 [0,2,0,0,0,0|2,0,0]=4 3312 B11R1.17 FCCSc1cccnc1Br 62a_100011217306_100010202626 [0,2,0,0,0,0|2,0,0]=4 3313 B11R1.17 FCCSc1cccnc1Cl 62a_100000036424_100011217306 [0,2,0,0,0,0|2,0,0]=4 3314 B11R1.17 FCCSc1cccnc1Cl 62a_100011217306_100000036424 [0,2,0,0,0,0|2,0,0]=4 3315 B11R1.17 FCCSc1cccnc1F 62a_100009816115_100011217306 [0,2,0,0,0,0|2,0,0]=4 3316 B11R1.17 FCCSc1cccnc1F 62a_100011217306_100009816115 [0,2,0,0,0,0|2,0,0]=4 3317 B11R1.17 FCCSc1cnccc1Br 62a_100010138639_100011217306 [0,2,0,0,0,0|2,0,0]=4 3318 B11R1.17 FCCSc1cnccc1Br 62a_100011217306_100010138639 [0,2,0,0,0,0|2,0,0]=4 3319 B11R1.17 FCCSc1cnccc1Cl 62a_100009995489_100011217306 [0,2,0,0,0,0|2,0,0]=4 3320 B11R1.17 FCCSc1cnccc1Cl 62a_100011217306_100009995489 [0,2,0,0,0,0|2,0,0]=4 3321 B11R1.17 FCCSc1cnccc1F 62a_100009820683_100011217306 [0,2,0,0,0,0|2,0,0]=4 3322 B11R1.17 FCCSc1cnccc1F 62a_100011217306_100009820683 [0,2,0,0,0,0|2,0,0]=4 3323 B11R1.17 FCCSc1ncccc1Br 62a_100000696092_100011217306 [0,2,0,0,0,0|2,0,0]=4 3324 B11R1.17 FCCSc1ncccc1Br 62a_100011217306_100000696092 [0,2,0,0,0,0|2,0,0]=4 3325 B11R1.17 FCCSc1ncccc1Cl 62a_100011217306_100011356963 [0,2,0,0,0,0|2,0,0]=4 3326 B11R1.17 FCCSc1ncccc1Cl 62a_100011356963_100011217306 [0,2,0,0,0,0|2,0,0]=4 3327 B11R1.17 FCCSc1ncccc1F 62a_100000685392_100011217306 [0,2,0,0,0,0|2,0,0]=4 3328 B11R1.17 FCCSc1ncccc1F 62a_100011217306_100000685392 [0,2,0,0,0,0|2,0,0]=4 3329 B11R1.17 FCCSc1nccnc1Cl 62a_100010886584_100011217306 [0,2,0,0,0,0|1,0,0]=3 3330 B11R1.17 FCCSc1nccnc1Cl 62a_100011217306_100010886584 [0,2,0,0,0,0|1,0,0]=3 3331 B11R1.17 FCCSc1nccnc1F 62a_100011217306_200010125657 [0,2,0,0,0,0|1,0,0]=3 3332 B11R1.17 FCCSc1nccnc1F 62a_200010125657_100011217306 [0,2,0,0,0,0|1,0,0]=3 3333 B11R1.17 FCNCc1cccnc1Br 34a_100009818023_100015361967 [0,2,0,0,0,0|2,0,0]=4 3334 B11R1.17 FCNCc1cccnc1Cl 34a_100015189234_100015361967 [0,2,0,0,0,0|2,0,0]=4 3335 B11R1.17 FCNCc1cccnc1F 34a_100000724633_100015361967 [0,2,0,0,0,0|2,0,0]=4 3336 B11R1.17 FCNCc1ncccc1F 34a_100000690088_100015361967 [0,2,0,0,0,0|2,0,0]=4 3337 B11R1.17 FCOCc1cccnc1Br 34a_100000719692_100015361967 [0,2,0,0,0,0|2,0,0]=4 3338 B11R1.17 FCOCc1cccnc1Br 7a_100000719692_100015361967 [0,2,0,0,0,0|2,0,0]=4 3339 B11R1.17 FCOCc1cccnc1Cl 34a_100000748726_100015361967 [0,2,0,0,0,0|2,0,0]=4 3340 B11R1.17 FCOCc1cccnc1Cl 7a_100000748726_100015361967 [0,2,0,0,0,0|2,0,0]=4 3341 B11R1.17 FCOCc1cccnc1F 34a_100000079888_100015361967 [0,2,0,0,0,0|2,0,0]=4 3342 B11R1.17 FCOCc1cccnc1F 7a_100000079888_100015361967 [0,2,0,0,0,0|2,0,0]=4 3343 B11R1.17 FCOCc1cnccc1Cl 34a_100000117392_100015361967 [0,2,0,0,0,0|2,0,0]=4 3344 B11R1.17 FCOCc1ncccc1Br 34a_100011996772_100015361967 [0,2,0,0,0,0|2,0,0]=4 3345 B11R1.17 FCOCc1ncccc1Cl 34a_100012002383_100015361967 [0,2,0,0,0,0|2,0,0]=4 3346 B11R1.17 FCOCc1ncccc1F 34a_100011934865_100015361967 [0,2,0,0,0,0|2,0,0]=4 3347 B11R1.17 FCOCc1nccnc1Cl 34a_100000057004_100015361967 [0,2,0,0,0,0|1,0,0]=3 3348 B11R1.17 FCSCc1cccnc1Br 62a_100010140945_100015361967 [0,2,0,0,0,0|2,0,0]=4 3349 B11R1.17 FCSCc1cccnc1Br 62a_100015361967_100010140945 [0,2,0,0,0,0|2,0,0]=4 3350 B11R1.17 FCSCc1cccnc1Cl 62a_100000045678_100015361967 [0,2,0,0,0,0|2,0,0]=4 3351 B11R1.17 FCSCc1cccnc1Cl 62a_100015361967_100000045678 [0,2,0,0,0,0|2,0,0]=4 3352 B11R1.17 FCSCc1cccnc1F 62a_100000099810_100015361967 [0,2,0,0,0,0|2,0,0]=4 3353 B11R1.17 FCSCc1cccnc1F 62a_100015361967_100000099810 [0,2,0,0,0,0|2,0,0]=4 3354 B11R1.17 FCSCc1ncccc1Br 62a_100015361967_100025702911 [0,2,0,0,0,0|2,0,0]=4 3355 B11R1.17 FCSCc1ncccc1Br 62a_100025702911_100015361967 [0,2,0,0,0,0|2,0,0]=4 3356 B11R1.17 FCSCc1ncccc1Cl 62a_100000099807_100015361967 [0,2,0,0,0,0|2,0,0]=4 3357 B11R1.17 FCSCc1ncccc1Cl 62a_100015361967_100000099807 [0,2,0,0,0,0|2,0,0]=4 3358 B11R1.17 FCSCc1ncccc1F 62a_100000104219_100015361967 [0,2,0,0,0,0|2,0,0]=4 3359 B11R1.17 FCSCc1ncccc1F 62a_100015361967_100000104219 [0,2,0,0,0,0|2,0,0]=4 3360 B11R1.17 N#CCSc1nccnc1Cl 62a_100010886584_100011215382 [0,2,0,0,0,0|1,0,1]=4 3361 B11R1.17 N#CCSc1nccnc1Cl 62a_100011215382_100010886584 [0,2,0,0,0,0|1,0,1]=4 3362 B11R1.17 N#CCSc1nccnc1F 62a_100011215382_200010125657 [0,2,0,0,0,0|1,0,1]=4 3363 B11R1.17 N#CCSc1nccnc1F 62a_200010125657_100011215382 [0,2,0,0,0,0|1,0,1]=4 3364 B11R1.17 N#CCSc1nccnc1N 62a_100000747729_100011215382 [0,2,0,0,0,0|1,0,1]=4 3365 B11R1.17 N#CCSc1nccnc1N 62a_100011215382_100000747729 [0,2,0,0,0,0|1,0,1]=4 3366 B11R1.17 Nc1cccnc1COCF 34a_114873767017_100015361967 [0,2,0,0,0,0|2,0,0]=4 3367 B11R1.17 Nc1cccnc1OCCF 34a_100000746358_100011217306 [0,2,0,0,0,0|2,0,0]=4 3368 B11R1.17 Nc1cccnc1OCCO 34a_100000746358_100000211926 [0,2,0,0,0,0|1,1,0]=4 3369 B11R1.17 Nc1cccnc1SCCF 62a_100000688686_100011217306 [0,2,0,0,0,0|2,0,0]=4 3370 B11R1.17 Nc1cccnc1SCCF 62a_100011217306_100000688686 [0,2,0,0,0,0|2,0,0]=4 3371 B11R1.17 Nc1cccnc1SCCO 62a_100000211926_100000688686 [0,2,0,0,0,0|1,1,0]=4 3372 B11R1.17 Nc1cccnc1SCCO 62a_100000688686_100000211926 [0,2,0,0,0,0|1,1,0]=4 3373 B11R1.17 Nc1ccncc1OCCF 34a_100000753702_100011217306 [0,2,0,0,0,0|2,0,0]=4 3374 B11R1.17 Nc1ccncc1OCCO 34a_100000753702_100000211926 [0,2,0,0,0,0|1,1,0]=4 3375 B11R1.17 Nc1ccncc1SCCF 62a_100000047001_100011217306 [0,2,0,0,0,0|2,0,0]=4 3376 B11R1.17 Nc1ccncc1SCCF 62a_100011217306_100000047001 [0,2,0,0,0,0|2,0,0]=4 3377 B11R1.17 Nc1ccncc1SCCO 62a_100000047001_100000211926 [0,2,0,0,0,0|1,1,0]=4 3378 B11R1.17 Nc1ccncc1SCCO 62a_100000211926_100000047001 [0,2,0,0,0,0|1,1,0]=4 3379 B11R1.17 Nc1ncccc1OCCF 34a_100000211975_100011217306 [0,2,0,0,0,0|2,0,0]=4 3380 B11R1.17 Nc1ncccc1OCCF 7a_100000211975_100011217306 [0,2,0,0,0,0|2,0,0]=4 3381 B11R1.17 Nc1ncccc1OCCO 34a_100000211975_100000211926 [0,2,0,0,0,0|1,1,0]=4 3382 B11R1.17 Nc1ncccc1OCCO 7a_100000211975_100000211926 [0,2,0,0,0,0|1,1,0]=4 3383 B11R1.17 Nc1ncccc1SCCF 62a_100000045569_100011217306 [0,2,0,0,0,0|2,0,0]=4 3384 B11R1.17 Nc1ncccc1SCCF 62a_100011217306_100000045569 [0,2,0,0,0,0|2,0,0]=4 3385 B11R1.17 Nc1ncccc1SCCO 62a_100000045569_100000211926 [0,2,0,0,0,0|1,1,0]=4 3386 B11R1.17 Nc1ncccc1SCCO 62a_100000211926_100000045569 [0,2,0,0,0,0|1,1,0]=4 3387 B11R1.17 Nc1nccnc1SCC=O 62a_100000747729_200015260668 [0,2,0,0,0,0|0,1,1]=4 3388 B11R1.17 Nc1nccnc1SCC=O 62a_200015260668_100000747729 [0,2,0,0,0,0|0,1,1]=4 3389 B11R1.17 Nc1nccnc1SCCF 62a_100000747729_100011217306 [0,2,0,0,0,0|1,0,0]=3 3390 B11R1.17 Nc1nccnc1SCCF 62a_100011217306_100000747729 [0,2,0,0,0,0|1,0,0]=3 3391 B11R1.17 Nc1nccnc1SCCO 62a_100000211926_100000747729 [0,2,0,0,0,0|0,1,0]=3 3392 B11R1.17 Nc1nccnc1SCCO 62a_100000747729_100000211926 [0,2,0,0,0,0|0,1,0]=3 3393 B11R1.17 O=CCSc1nccnc1Cl 62a_100010886584_200015260668 [0,2,0,0,0,0|0,1,1]=4 3394 B11R1.17 O=CCSc1nccnc1Cl 62a_200015260668_100010886584 [0,2,0,0,0,0|0,1,1]=4 3395 B11R1.17 O=CCSc1nccnc1F 62a_200010125657_200015260668 [0,2,0,0,0,0|0,1,1]=4 3396 B11R1.17 O=CCSc1nccnc1F 62a_200015260668_200010125657 [0,2,0,0,0,0|0,1,1]=4 3397 B11R1.17 O=c1[nH]ccnc1SCCF 62a_100011217306_100000763361 [0,2,0,0,0,0|1,0,1]=4 3398 B11R1.17 O=c1[nH]ccnc1SCCO 62a_100000211926_100000763361 [0,2,0,0,0,0|0,1,1]=4 3399 B11R1.17 OCCNc1ncccc1Br 27a_100000210304_100000696092 [0,2,0,0,0,0|1,1,0]=4 3400 B11R1.17 OCCNc1ncccc1O 271570a_203496583355_200011464885 [0,2,0,0,0,0|1,1,0]=4 3401 B11R1.17 OCCNc1nccnc1F 27a_100000210304_200010125657 [0,2,0,0,0,0|0,1,0]=3 3402 B11R1.17 OCCNc1nccnc1O 271570a_203496583355_200011219046 [0,2,0,0,0,0|0,1,0]=3 3403 B11R1.17 OCCOc1cccnc1Br 34a_100000744436_100000211926 [0,2,0,0,0,0|1,1,0]=4 3404 B11R1.17 OCCOc1cccnc1Br 7a_100000744436_100000211926 [0,2,0,0,0,0|1,1,0]=4 3405 B11R1.17 OCCOc1cccnc1Cl 34a_100000757616_100000211926 [0,2,0,0,0,0|1,1,0]=4 3406 B11R1.17 OCCOc1cccnc1Cl 7a_100000757616_100000211926 [0,2,0,0,0,0|1,1,0]=4 3407 B11R1.17 OCCOc1cccnc1F 34a_100000061740_100000211926 [0,2,0,0,0,0|1,1,0]=4 3408 B11R1.17 OCCOc1cccnc1F 7a_100000061740_100000211926 [0,2,0,0,0,0|1,1,0]=4 3409 B11R1.17 OCCOc1cccnc1I 34a_100000034122_100000211926 [0,2,0,0,0,0|1,1,0]=4 3410 B11R1.17 OCCOc1cccnc1I 7a_100000034122_100000211926 [0,2,0,0,0,0|1,1,0]=4 3411 B11R1.17 OCCOc1cnccc1Cl 34a_100011996695_100000211926 [0,2,0,0,0,0|1,1,0]=4 3412 B11R1.17 OCCOc1cnccc1I 34a_100000050107_100000211926 [0,2,0,0,0,0|1,1,0]=4 3413 B11R1.17 OCCOc1ncccc1Cl 34a_100011290957_100000211926 [0,2,0,0,0,0|1,1,0]=4 3414 B11R1.17 OCCOc1ncccc1F 34a_100011219419_100000211926 [0,2,0,0,0,0|1,1,0]=4 3415 B11R1.17 OCCSc1cccnc1Br 62a_100000211926_100010202626 [0,2,0,0,0,0|1,1,0]=4 3416 B11R1.17 OCCSc1cccnc1Br 62a_100010202626_100000211926 [0,2,0,0,0,0|1,1,0]=4 3417 B11R1.17 OCCSc1cccnc1Cl 62a_100000036424_100000211926 [0,2,0,0,0,0|1,1,0]=4 3418 B11R1.17 OCCSc1cccnc1Cl 62a_100000211926_100000036424 [0,2,0,0,0,0|1,1,0]=4 3419 B11R1.17 OCCSc1cccnc1F 62a_100000211926_100009816115 [0,2,0,0,0,0|1,1,0]=4 3420 B11R1.17 OCCSc1cccnc1F 62a_100009816115_100000211926 [0,2,0,0,0,0|1,1,0]=4 3421 B11R1.17 OCCSc1cccnc1O 62a_100000211926_100000760158 [0,2,0,0,0,0|1,1,0]=4 3422 B11R1.17 OCCSc1cccnc1O 62a_100000760158_100000211926 [0,2,0,0,0,0|1,1,0]=4 3423 B11R1.17 OCCSc1cnccc1Br 62a_100000211926_100010138639 [0,2,0,0,0,0|1,1,0]=4 3424 B11R1.17 OCCSc1cnccc1Br 62a_100010138639_100000211926 [0,2,0,0,0,0|1,1,0]=4 3425 B11R1.17 OCCSc1cnccc1Cl 62a_100000211926_100009995489 [0,2,0,0,0,0|1,1,0]=4 3426 B11R1.17 OCCSc1cnccc1Cl 62a_100009995489_100000211926 [0,2,0,0,0,0|1,1,0]=4 3427 B11R1.17 OCCSc1cnccc1F 62a_100000211926_100009820683 [0,2,0,0,0,0|1,1,0]=4 3428 B11R1.17 OCCSc1cnccc1F 62a_100009820683_100000211926 [0,2,0,0,0,0|1,1,0]=4 3429 B11R1.17 OCCSc1ncccc1Br 62a_100000211926_100000696092 [0,2,0,0,0,0|1,1,0]=4 3430 B11R1.17 OCCSc1ncccc1Br 62a_100000696092_100000211926 [0,2,0,0,0,0|1,1,0]=4 3431 B11R1.17 OCCSc1ncccc1Cl 62a_100000211926_100011356963 [0,2,0,0,0,0|1,1,0]=4 3432 B11R1.17 OCCSc1ncccc1Cl 62a_100011356963_100000211926 [0,2,0,0,0,0|1,1,0]=4 3433 B11R1.17 OCCSc1ncccc1F 62a_100000211926_100000685392 [0,2,0,0,0,0|1,1,0]=4 3434 B11R1.17 OCCSc1ncccc1F 62a_100000685392_100000211926 [0,2,0,0,0,0|1,1,0]=4 3435 B11R1.17 OCCSc1ncccc1O 62a_100000034122_100000211926 [0,2,0,0,0,0|1,1,0]=4 3436 B11R1.17 OCCSc1ncccc1O 62a_100000211926_100000034122 [0,2,0,0,0,0|1,1,0]=4 3437 B11R1.17 OCCSc1nccnc1Cl 62a_100000211926_100010886584 [0,2,0,0,0,0|0,1,0]=3 3438 B11R1.17 OCCSc1nccnc1Cl 62a_100010886584_100000211926 [0,2,0,0,0,0|0,1,0]=3 3439 B11R1.17 OCCSc1nccnc1F 62a_100000211926_200010125657 [0,2,0,0,0,0|0,1,0]=3 3440 B11R1.17 OCCSc1nccnc1F 62a_200010125657_100000211926 [0,2,0,0,0,0|0,1,0]=3 3441 B11R1.17 Oc1cccnc1CSCF 62a_100015361967_200020655725 [0,2,0,0,0,0|2,0,0]=4 3442 B11R1.17 Oc1cccnc1CSCF 62a_200020655725_100015361967 [0,2,0,0,0,0|2,0,0]=4 3443 B11R1.17 Oc1cccnc1SCCF 62a_100000034122_100011217306 [0,2,0,0,0,0|2,0,0]=4 3444 B11R1.17 Oc1cccnc1SCCF 62a_100011217306_100000034122 [0,2,0,0,0,0|2,0,0]=4 3445 B11R1.17 Oc1ncccc1OCCF 271570a_203496583355_100012814765 [0,2,0,0,0,0|2,0,0]=4 3446 B11R1.17 Oc1ncccc1SCCF 62a_100000760158_100011217306 [0,2,0,0,0,0|2,0,0]=4 3447 B11R1.17 Oc1ncccc1SCCF 62a_100011217306_100000760158 [0,2,0,0,0,0|2,0,0]=4 3448 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_100012161201_200025704644 [0,2,0,0,0,0|2,0,0]=4 3449 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_200025704644_100012161201 [0,2,0,0,0,0|2,0,0]=4 3450 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_100011713703_200025704644 [0,2,0,0,0,0|2,0,0]=4 3451 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_200025704644_100011713703 [0,2,0,0,0,0|2,0,0]=4 3452 B11R1.17 [13CH3]SCCc1ccccc1F 62a_100011713696_200025704644 [0,2,0,0,0,0|2,0,0]=4 3453 B11R1.17 [13CH3]SCCc1ccccc1F 62a_200025704644_100011713696 [0,2,0,0,0,0|2,0,0]=4 3454 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [0,2,0,0,0,0|2,0,0]=4 3455 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [0,2,0,0,0,0|2,0,0]=4 3456 B11R1.41 C=Cc1nccnc1OCC 271570a_100011290941_200010128176 [0,2,0,0,0,0|2,0,0]=4 3457 B11R1.41 CCNc1nccnc1C#N 27a_100015525214_100000040484 [0,2,0,0,0,0|2,0,0]=4 3458 B11R1.41 CCNc1nccnc1CC 27a_100015525214_100011995844 [0,2,0,0,0,0|2,0,0]=4 3459 B11R1.41 CCNc1nccnc1OC 27a_100015525214_100009858322 [0,2,0,0,0,0|2,0,0]=4 3460 B11R1.41 CCOc1nccnc1NC 27a_100102657272_200010128176 [0,2,0,0,0,0|2,0,0]=4 3461 B11R1.41 CCOc1nccnc1SC 62a_200000210301_200010128176 [0,2,0,0,0,0|2,0,0]=4 3462 B11R1.41 CCOc1nccnc1SC 62a_200010128176_200000210301 [0,2,0,0,0,0|2,0,0]=4 3463 B11R1.41 CCOc1nccnc1S[13CH3] 62a_200010128176_200025704644 [0,2,0,0,0,0|2,0,0]=4 3464 B11R1.41 CCOc1nccnc1S[13CH3] 62a_200025704644_200010128176 [0,2,0,0,0,0|2,0,0]=4 3465 B11R1.41 CCSc1nccnc1C#N 62a_100000210202_100000040484 [0,2,0,0,0,0|2,0,0]=4 3466 B11R1.41 CCSc1nccnc1C=O 62a_100000051000_100000210202 [0,2,0,0,0,0|2,0,0]=4 3467 B11R1.41 CCSc1nccnc1C=O 62a_100000210202_100000051000 [0,2,0,0,0,0|2,0,0]=4 3468 B11R1.41 CCSc1nccnc1CC 62a_100000210202_100011995844 [0,2,0,0,0,0|2,0,0]=4 3469 B11R1.41 CCSc1nccnc1CC 62a_100011995844_100000210202 [0,2,0,0,0,0|2,0,0]=4 3470 B11R1.41 CCSc1nccnc1CN 62a_100000210202_100000729963 [0,2,0,0,0,0|2,0,0]=4 3471 B11R1.41 CCSc1nccnc1CN 62a_100000729963_100000210202 [0,2,0,0,0,0|2,0,0]=4 3472 B11R1.41 CCSc1nccnc1CO 62a_100000057004_100000210202 [0,2,0,0,0,0|2,0,0]=4 3473 B11R1.41 CCSc1nccnc1CO 62a_100000210202_100000057004 [0,2,0,0,0,0|2,0,0]=4 3474 B11R1.41 CCSc1nccnc1NC 62a_100000210202_100011529439 [0,2,0,0,0,0|2,0,0]=4 3475 B11R1.41 CCSc1nccnc1NN 62a_100000210202_100000755098 [0,2,0,0,0,0|2,0,0]=4 3476 B11R1.41 CCSc1nccnc1OC 62a_100000210202_100000749998 [0,2,0,0,0,0|2,0,0]=4 3477 B11R1.41 CCSc1nccnc1OC 62a_100009858322_100000210202 [0,2,0,0,0,0|2,0,0]=4 3478 B11R1.41 CCc1nccnc1SCF 62a_100011995844_100015361967 [0,2,0,0,0,0|2,0,0]=4 3479 B11R1.41 CCc1nccnc1SCF 62a_100015361967_100011995844 [0,2,0,0,0,0|2,0,0]=4 3480 B11R1.41 CNc1nccnc1SCF 62a_100015361967_100011529439 [0,2,0,0,0,0|2,0,0]=4 3481 B11R1.41 COc1nccnc1SCF 62a_100009858322_100015361967 [0,2,0,0,0,0|2,0,0]=4 3482 B11R1.41 COc1nccnc1SCF 62a_100015361967_100000749998 [0,2,0,0,0,0|2,0,0]=4 3483 B11R1.41 N#Cc1nccnc1SCF 62a_100015361967_100000040484 [0,2,0,0,0,0|2,0,0]=4 3484 B11R1.41 NCc1nccnc1SCF 62a_100000729963_100015361967 [0,2,0,0,0,0|2,0,0]=4 3485 B11R1.41 NCc1nccnc1SCF 62a_100015361967_100000729963 [0,2,0,0,0,0|2,0,0]=4 3486 B11R1.41 NNc1nccnc1SCF 62a_100015361967_100000755098 [0,2,0,0,0,0|2,0,0]=4 3487 B11R1.41 O=Cc1nccnc1SCF 62a_100000051000_100015361967 [0,2,0,0,0,0|2,0,0]=4 3488 B11R1.41 O=Cc1nccnc1SCF 62a_100015361967_100000051000 [0,2,0,0,0,0|2,0,0]=4 3489 B11R1.41 OCc1nccnc1SCF 62a_100000057004_100015361967 [0,2,0,0,0,0|2,0,0]=4 3490 B11R1.41 OCc1nccnc1SCF 62a_100015361967_100000057004 [0,2,0,0,0,0|2,0,0]=4 3491 B11R1.86 CC(C)Nc1nccnc1F 27a_100138425928_200010125657 [0,2,0,0,0,0|2,0,0]=4 3492 B11R1.86 CC(C)Sc1nccnc1Cl 62a_100000210206_100010886584 [0,2,0,0,0,0|2,0,0]=4 3493 B11R1.86 CC(C)Sc1nccnc1Cl 62a_100010886584_100000210206 [0,2,0,0,0,0|2,0,0]=4 3494 B11R1.86 CC(C)Sc1nccnc1F 62a_100000210206_200010125657 [0,2,0,0,0,0|2,0,0]=4 3495 B11R1.86 CC(C)Sc1nccnc1F 62a_200010125657_100000210206 [0,2,0,0,0,0|2,0,0]=4 3496 B11R1.86 CC(C)Sc1nccnc1N 62a_100000210206_100000747729 [0,2,0,0,0,0|2,0,0]=4 3497 B11R1.86 CC(C)Sc1nccnc1N 62a_100000747729_100000210206 [0,2,0,0,0,0|2,0,0]=4 3498 B11R1.86 Cc1nccnc1CN(C)C 270004a_100102631434_100000050726 [0,2,0,0,0,0|2,0,0]=4 3499 B11R1.86 Cc1nccnc1NC(C)C 27a_100138425928_100011999405 [0,2,0,0,0,0|2,0,0]=4 3500 B11R1.86 Cc1nccnc1OC(C)C 34a_100000766352_100000210206 [0,2,0,0,0,0|2,0,0]=4 3501 B11R1.86 Cc1nccnc1SC(C)C 62a_100000210206_100011999405 [0,2,0,0,0,0|2,0,0]=4 3502 B11R1.86 Cc1nccnc1SC(C)C 62a_100011999405_100000210206 [0,2,0,0,0,0|2,0,0]=4 3503 B11R1.182 CCNc1nc(cnc1C)C 27a_100015525214_100000211308 [0,2,0,0,0,0|2,0,0]=4 3504 B11R1.182 CCNc1nc(cnc1N)O 271570a_203496583355_200010196044 [0,2,0,0,0,0|2,0,0]=4 3505 B11R1.182 CCOc1nc(cnc1N)O 271570a_203496583355_200010196039 [0,2,0,0,0,0|2,0,0]=4 3506 B11R1.182 CCSc1nc(cnc1C)C 62a_100000210202_100000211308 [0,2,0,0,0,0|2,0,0]=4 3507 B11R1.182 CCSc1nc(cnc1C)C 62a_100000211308_100000210202 [0,2,0,0,0,0|2,0,0]=4 3508 B11R1.182 CCSc1nc(cnc1C)N 62a_100000210202_100009877824 [0,2,0,0,0,0|2,0,0]=4 3509 B11R1.182 CCSc1nc(cnc1C)N 62a_100009877824_100000210202 [0,2,0,0,0,0|2,0,0]=4 3510 B11R1.182 CCSc1nc(cnc1N)Br 62a_100000210202_100010988662 [0,2,0,0,0,0|2,0,0]=4 3511 B11R1.182 CCSc1nc(cnc1N)Br 62a_100010988662_100000210202 [0,2,0,0,0,0|2,0,0]=4 3512 B11R1.182 CCSc1nc(cnc1N)C 62a_100000210202_100009819049 [0,2,0,0,0,0|2,0,0]=4 3513 B11R1.182 CCSc1nc(cnc1N)C 62a_100009819049_100000210202 [0,2,0,0,0,0|2,0,0]=4 3514 B11R1.182 Cc1cnc(c(n1)SCF)C 62a_100000211308_100015361967 [0,2,0,0,0,0|2,0,0]=4 3515 B11R1.182 Cc1cnc(c(n1)SCF)C 62a_100015361967_100000211308 [0,2,0,0,0,0|2,0,0]=4 3516 B11R1.182 Cc1cnc(c(n1)SCF)N 62a_100009819049_100015361967 [0,2,0,0,0,0|2,0,0]=4 3517 B11R1.182 Cc1cnc(c(n1)SCF)N 62a_100015361967_100009819049 [0,2,0,0,0,0|2,0,0]=4 3518 B11R1.182 Cc1ncc(nc1SCF)N 62a_100009877824_100015361967 [0,2,0,0,0,0|2,0,0]=4 3519 B11R1.182 Cc1ncc(nc1SCF)N 62a_100015361967_100009877824 [0,2,0,0,0,0|2,0,0]=4 3520 B11R1.182 Nc1ncc(nc1SCF)Br 62a_100010988662_100015361967 [0,2,0,0,0,0|2,0,0]=4 3521 B11R1.182 Nc1ncc(nc1SCF)Br 62a_100015361967_100010988662 [0,2,0,0,0,0|2,0,0]=4 3522 B11R1.222 CNC(C)c1nccnc1C 269862a_106832991636_100000702048 [0,2,0,0,0,0|2,0,0]=4 3523 B11R1.222 CNC(C)c1nccnc1Cl 269862a_106832991636_100000099859 [0,2,0,0,0,0|2,0,0]=4 3524 B11R1.24 C#CCNc1cncc(n1)C 27a_100000212058_100000754123 [0,2,0,0,0,0|1,0,1]=4 3525 B11R1.24 C#CCNc1cncc(n1)Cl 27a_100000212058_100010892449 [0,2,0,0,0,0|1,0,1]=4 3526 B11R1.24 C#CCNc1cncc(n1)F 27a_100000212058_200009863489 [0,2,0,0,0,0|1,0,1]=4 3527 B11R1.24 C#CCSc1cncc(n1)C 62a_100000038162_100000754123 [0,2,0,0,0,0|1,0,1]=4 3528 B11R1.24 C#CCSc1cncc(n1)Cl 62a_100000038162_100010892449 [0,2,0,0,0,0|1,0,1]=4 3529 B11R1.24 C#CCSc1cncc(n1)F 62a_100000038162_200009863489 [0,2,0,0,0,0|1,0,1]=4 3530 B11R1.24 C#CCSc1cncc(n1)N 62a_100000038162_100000747728 [0,2,0,0,0,0|1,0,1]=4 3531 B11R1.24 C#CCSc1cncc(n1)O 62a_100000038162_100011269956 [0,2,0,0,0,0|1,0,1]=4 3532 B11R1.24 C=CCNc1cncc(n1)C 27a_100020586998_100000754123 [0,2,0,0,0,0|1,0,1]=4 3533 B11R1.24 C=CCNc1cncc(n1)Cl 27a_100020586998_100010892449 [0,2,0,0,0,0|1,0,1]=4 3534 B11R1.24 C=CCNc1cncc(n1)F 27a_100020586998_200009863489 [0,2,0,0,0,0|1,0,1]=4 3535 B11R1.24 C=CCSc1cncc(n1)C 62a_100000210623_100000754123 [0,2,0,0,0,0|1,0,1]=4 3536 B11R1.24 C=CCSc1cncc(n1)C 62a_100000754123_100000210623 [0,2,0,0,0,0|1,0,1]=4 3537 B11R1.24 C=CCSc1cncc(n1)Cl 62a_100000210623_100010892449 [0,2,0,0,0,0|1,0,1]=4 3538 B11R1.24 C=CCSc1cncc(n1)Cl 62a_100010892449_100000210623 [0,2,0,0,0,0|1,0,1]=4 3539 B11R1.24 C=CCSc1cncc(n1)F 62a_100000210623_200009863489 [0,2,0,0,0,0|1,0,1]=4 3540 B11R1.24 C=CCSc1cncc(n1)F 62a_200009863489_100000210623 [0,2,0,0,0,0|1,0,1]=4 3541 B11R1.24 C=CCSc1cncc(n1)N 62a_100000210623_100000747728 [0,2,0,0,0,0|1,0,1]=4 3542 B11R1.24 C=CCSc1cncc(n1)N 62a_100000747728_100000210623 [0,2,0,0,0,0|1,0,1]=4 3543 B11R1.24 C=CCSc1cncc(n1)O 62a_100000210623_100011269956 [0,2,0,0,0,0|1,0,1]=4 3544 B11R1.24 CCCCc1c[n+](ccn1)[O-] 271570a_100020621405_100009880115 [0,2,0,0,0,0|1,0,1]=4 3545 B11R1.24 CCCCc1cc(ccn1)C 271570a_100020621405_100000750283 [0,2,0,0,0,0|2,0,0]=4 3546 B11R1.24 CCCCc1cc(ccn1)Cl 271570a_100020621405_100010167805 [0,2,0,0,0,0|2,0,0]=4 3547 B11R1.24 CCCCc1cc(ccn1)F 271570a_100020621405_100009817058 [0,2,0,0,0,0|2,0,0]=4 3548 B11R1.24 CCCCc1cc(ccn1)N 271570a_100020621405_100009814236 [0,2,0,0,0,0|2,0,0]=4 3549 B11R1.24 CCCCc1cc(ccn1)O 271570a_100020621405_100000762945 [0,2,0,0,0,0|2,0,0]=4 3550 B11R1.24 CCCCc1cccc(n1)Br 271570a_100020621405_100000684672 [0,2,0,0,0,0|2,0,0]=4 3551 B11R1.24 CCCCc1cccc(n1)C 271570a_100020621405_100000742759 [0,2,0,0,0,0|2,0,0]=4 3552 B11R1.24 CCCCc1cccc(n1)F 271570a_100020621405_100009815982 [0,2,0,0,0,0|2,0,0]=4 3553 B11R1.24 CCCCc1cccc(n1)N 271570a_100020621405_100000740741 [0,2,0,0,0,0|2,0,0]=4 3554 B11R1.24 CCCCc1cncc(c1)Br 271570a_100020621405_100000728054 [0,2,0,0,0,0|2,0,0]=4 3555 B11R1.24 CCCCc1cncc(c1)C 271570a_100020621405_100000760492 [0,2,0,0,0,0|2,0,0]=4 3556 B11R1.24 CCCCc1cncc(c1)Cl 271570a_100020621405_100000049639 [0,2,0,0,0,0|2,0,0]=4 3557 B11R1.24 CCCCc1cncc(c1)F 271570a_100020621405_100000744099 [0,2,0,0,0,0|2,0,0]=4 3558 B11R1.24 CCCCc1cncc(c1)N 271570a_100020621405_100000687067 [0,2,0,0,0,0|2,0,0]=4 3559 B11R1.24 CCCCc1cncc(c1)O 271570a_100020621405_100000754920 [0,2,0,0,0,0|2,0,0]=4 3560 B11R1.24 CCCCc1cncc(n1)C 271570a_100020621405_100009842155 [0,2,0,0,0,0|1,0,0]=3 3561 B11R1.24 CCCCc1cncc(n1)F 271570a_100020621405_200009863489 [0,2,0,0,0,0|1,0,0]=3 3562 B11R1.24 CCCCc1cncc(n1)N 271570a_100020621405_100009819714 [0,2,0,0,0,0|1,0,0]=3 3563 B11R1.24 CCCCc1cncc(n1)O 271570a_100020621405_100011269956 [0,2,0,0,0,0|1,0,0]=3 3564 B11R1.24 CCCNc1cccc(n1)O 271570a_203496583355_200025756634 [0,2,0,0,0,0|2,0,0]=4 3565 B11R1.24 CCCNc1cncc(n1)O 271570a_203496583355_200011529425 [0,2,0,0,0,0|1,0,0]=3 3566 B11R1.24 CCCOc1cccc(n1)F 34a_100011432558_100000210303 [0,2,0,0,0,0|2,0,0]=4 3567 B11R1.24 CCCOc1cccc(n1)O 271570a_203496583355_200011960250 [0,2,0,0,0,0|2,0,0]=4 3568 B11R1.24 CCCOc1cncc(c1)Br 34a_100000754920_100000210303 [0,2,0,0,0,0|2,0,0]=4 3569 B11R1.24 CCCOc1cncc(c1)Br 7a_100000754920_100000210303 [0,2,0,0,0,0|2,0,0]=4 3570 B11R1.24 CCCOc1cncc(c1)C 34a_100011830280_100000210303 [0,2,0,0,0,0|2,0,0]=4 3571 B11R1.24 CCCOc1cncc(c1)C 7a_100011830280_100000210303 [0,2,0,0,0,0|2,0,0]=4 3572 B11R1.24 CCCOc1cncc(c1)Cl 7a_100000032511_100000210303 [0,2,0,0,0,0|2,0,0]=4 3573 B11R1.24 CCCOc1cncc(c1)F 34a_100011830296_100000210303 [0,2,0,0,0,0|2,0,0]=4 3574 B11R1.24 CCCOc1cncc(c1)F 7a_100011830296_100000210303 [0,2,0,0,0,0|2,0,0]=4 3575 B11R1.24 CCCOc1cncc(c1)N 34a_100011997051_100000210303 [0,2,0,0,0,0|2,0,0]=4 3576 B11R1.24 CCCOc1cncc(c1)O 271570a_203496583355_200012029621 [0,2,0,0,0,0|2,0,0]=4 3577 B11R1.24 CCCSc1c[n+](ccn1)[O-] 62a_100000210303_100009880115 [0,2,0,0,0,0|1,0,1]=4 3578 B11R1.24 CCCSc1cc(ccn1)C 62a_100000210303_100000750283 [0,2,0,0,0,0|2,0,0]=4 3579 B11R1.24 CCCSc1cc(ccn1)C 62a_100000750283_100000210303 [0,2,0,0,0,0|2,0,0]=4 3580 B11R1.24 CCCSc1cc(ccn1)Cl 62a_100000210303_100010167805 [0,2,0,0,0,0|2,0,0]=4 3581 B11R1.24 CCCSc1cc(ccn1)Cl 62a_100010167805_100000210303 [0,2,0,0,0,0|2,0,0]=4 3582 B11R1.24 CCCSc1cc(ccn1)F 62a_100000210303_100000764206 [0,2,0,0,0,0|2,0,0]=4 3583 B11R1.24 CCCSc1cc(ccn1)F 62a_100000764206_100000210303 [0,2,0,0,0,0|2,0,0]=4 3584 B11R1.24 CCCSc1cc(ccn1)N 62a_100000210303_100009814236 [0,2,0,0,0,0|2,0,0]=4 3585 B11R1.24 CCCSc1cc(ccn1)N 62a_100009814236_100000210303 [0,2,0,0,0,0|2,0,0]=4 3586 B11R1.24 CCCSc1cc(ccn1)O 62a_100000210303_100000762945 [0,2,0,0,0,0|2,0,0]=4 3587 B11R1.24 CCCSc1cccc(n1)Br 62a_100000210303_100000684672 [0,2,0,0,0,0|2,0,0]=4 3588 B11R1.24 CCCSc1cccc(n1)Br 62a_100000684672_100000210303 [0,2,0,0,0,0|2,0,0]=4 3589 B11R1.24 CCCSc1cccc(n1)C 62a_100000210303_100000742759 [0,2,0,0,0,0|2,0,0]=4 3590 B11R1.24 CCCSc1cccc(n1)C 62a_100000742759_100000210303 [0,2,0,0,0,0|2,0,0]=4 3591 B11R1.24 CCCSc1cccc(n1)Cl 62a_100000051397_100000210303 [0,2,0,0,0,0|2,0,0]=4 3592 B11R1.24 CCCSc1cccc(n1)Cl 62a_100000210303_100000051397 [0,2,0,0,0,0|2,0,0]=4 3593 B11R1.24 CCCSc1cccc(n1)F 62a_100000210303_100009815982 [0,2,0,0,0,0|2,0,0]=4 3594 B11R1.24 CCCSc1cccc(n1)F 62a_100009815982_100000210303 [0,2,0,0,0,0|2,0,0]=4 3595 B11R1.24 CCCSc1cccc(n1)N 62a_100000210303_100000740741 [0,2,0,0,0,0|2,0,0]=4 3596 B11R1.24 CCCSc1cccc(n1)N 62a_100000740741_100000210303 [0,2,0,0,0,0|2,0,0]=4 3597 B11R1.24 CCCSc1cncc(c1)Br 62a_100000210303_100000728054 [0,2,0,0,0,0|2,0,0]=4 3598 B11R1.24 CCCSc1cncc(c1)Br 62a_100000728054_100000210303 [0,2,0,0,0,0|2,0,0]=4 3599 B11R1.24 CCCSc1cncc(c1)C 62a_100000210303_100000760492 [0,2,0,0,0,0|2,0,0]=4 3600 B11R1.24 CCCSc1cncc(c1)C 62a_100000760492_100000210303 [0,2,0,0,0,0|2,0,0]=4 3601 B11R1.24 CCCSc1cncc(c1)Cl 62a_100000049639_100000210303 [0,2,0,0,0,0|2,0,0]=4 3602 B11R1.24 CCCSc1cncc(c1)Cl 62a_100000210303_100000049639 [0,2,0,0,0,0|2,0,0]=4 3603 B11R1.24 CCCSc1cncc(c1)F 62a_100000210303_100000744099 [0,2,0,0,0,0|2,0,0]=4 3604 B11R1.24 CCCSc1cncc(c1)F 62a_100000744099_100000210303 [0,2,0,0,0,0|2,0,0]=4 3605 B11R1.24 CCCSc1cncc(c1)N 62a_100000210303_100000687067 [0,2,0,0,0,0|2,0,0]=4 3606 B11R1.24 CCCSc1cncc(c1)N 62a_100000687067_100000210303 [0,2,0,0,0,0|2,0,0]=4 3607 B11R1.24 CCCSc1cncc(c1)O 62a_100000210303_100000754920 [0,2,0,0,0,0|2,0,0]=4 3608 B11R1.24 CCCSc1cncc(c1)O 62a_100000754920_100000210303 [0,2,0,0,0,0|2,0,0]=4 3609 B11R1.24 CCCSc1cncc(n1)C 62a_100000210303_100000754123 [0,2,0,0,0,0|1,0,0]=3 3610 B11R1.24 CCCSc1cncc(n1)C 62a_100000754123_100000210303 [0,2,0,0,0,0|1,0,0]=3 3611 B11R1.24 CCCSc1cncc(n1)Cl 62a_100000210303_100010892449 [0,2,0,0,0,0|1,0,0]=3 3612 B11R1.24 CCCSc1cncc(n1)Cl 62a_100010892449_100000210303 [0,2,0,0,0,0|1,0,0]=3 3613 B11R1.24 CCCSc1cncc(n1)F 62a_100000210303_200009863489 [0,2,0,0,0,0|1,0,0]=3 3614 B11R1.24 CCCSc1cncc(n1)F 62a_200009863489_100000210303 [0,2,0,0,0,0|1,0,0]=3 3615 B11R1.24 CCCSc1cncc(n1)N 62a_100000210303_100000747728 [0,2,0,0,0,0|1,0,0]=3 3616 B11R1.24 CCCSc1cncc(n1)N 62a_100000747728_100000210303 [0,2,0,0,0,0|1,0,0]=3 3617 B11R1.24 CCCSc1cncc(n1)O 62a_100000210303_100011269956 [0,2,0,0,0,0|1,0,0]=3 3618 B11R1.24 CCNCc1cc(ccn1)Br 2230a_100015525214_100010173614 [0,2,0,0,0,0|2,0,0]=4 3619 B11R1.24 CCNCc1cc(ccn1)Br 270004a_100015525214_100009818557 [0,2,0,0,0,0|2,0,0]=4 3620 B11R1.24 CCNCc1cc(ccn1)C 207a_100015525214_100011361488 [0,2,0,0,0,0|2,0,0]=4 3621 B11R1.24 CCNCc1cc(ccn1)C 2230a_100015525214_100000718516 [0,2,0,0,0,0|2,0,0]=4 3622 B11R1.24 CCNCc1cc(ccn1)C 270004a_100015525214_100011361488 [0,2,0,0,0,0|2,0,0]=4 3623 B11R1.24 CCNCc1cc(ccn1)Cl 2230a_100015525214_100016988179 [0,2,0,0,0,0|2,0,0]=4 3624 B11R1.24 CCNCc1cc(ccn1)Cl 270004a_100015525214_100011998288 [0,2,0,0,0,0|2,0,0]=4 3625 B11R1.24 CCNCc1cccc(n1)Br 2230a_100015525214_100009889011 [0,2,0,0,0,0|2,0,0]=4 3626 B11R1.24 CCNCc1cccc(n1)Br 2230a_100016987751_100000210202 [0,2,0,0,0,0|2,0,0]=4 3627 B11R1.24 CCNCc1cccc(n1)Br 270004a_100015525214_100000688028 [0,2,0,0,0,0|2,0,0]=4 3628 B11R1.24 CCNCc1cccc(n1)C 207a_100015525214_100011215050 [0,2,0,0,0,0|2,0,0]=4 3629 B11R1.24 CCNCc1cccc(n1)C 2230a_100015525214_100000757606 [0,2,0,0,0,0|2,0,0]=4 3630 B11R1.24 CCNCc1cccc(n1)C 270004a_100015525214_100011215050 [0,2,0,0,0,0|2,0,0]=4 3631 B11R1.24 CCNCc1cccc(n1)C 34a_100000701342_100000210202 [0,2,0,0,0,0|2,0,0]=4 3632 B11R1.24 CCNCc1cccc(n1)Cl 2230a_100015525214_100000086093 [0,2,0,0,0,0|2,0,0]=4 3633 B11R1.24 CCNCc1cccc(n1)Cl 2230a_100016990191_100000210202 [0,2,0,0,0,0|2,0,0]=4 3634 B11R1.24 CCNCc1cccc(n1)Cl 270004a_100015525214_100011361687 [0,2,0,0,0,0|2,0,0]=4 3635 B11R1.24 CCNCc1cccc(n1)F 2230a_100015188798_100000210202 [0,2,0,0,0,0|2,0,0]=4 3636 B11R1.24 CCNCc1cccc(n1)F 2230a_100015525214_100009819644 [0,2,0,0,0,0|2,0,0]=4 3637 B11R1.24 CCNCc1cccc(n1)F 270004a_100015525214_100000050434 [0,2,0,0,0,0|2,0,0]=4 3638 B11R1.24 CCNCc1cccc(n1)F 34a_100015188798_100000210202 [0,2,0,0,0,0|2,0,0]=4 3639 B11R1.24 CCNCc1cncc(c1)Br 207a_100015525214_100000687066 [0,2,0,0,0,0|2,0,0]=4 3640 B11R1.24 CCNCc1cncc(c1)Br 2230a_100015525214_100000738771 [0,2,0,0,0,0|2,0,0]=4 3641 B11R1.24 CCNCc1cncc(c1)Br 270004a_100015525214_100000687066 [0,2,0,0,0,0|2,0,0]=4 3642 B11R1.24 CCNCc1cncc(c1)C 207a_100015525214_100011998712 [0,2,0,0,0,0|2,0,0]=4 3643 B11R1.24 CCNCc1cncc(c1)C 2230a_100000692839_100000210202 [0,2,0,0,0,0|2,0,0]=4 3644 B11R1.24 CCNCc1cncc(c1)C 2230a_100015525214_100000716715 [0,2,0,0,0,0|2,0,0]=4 3645 B11R1.24 CCNCc1cncc(c1)C 270004a_100015525214_100011998712 [0,2,0,0,0,0|2,0,0]=4 3646 B11R1.24 CCNCc1cncc(c1)C 34a_100000692839_100000210202 [0,2,0,0,0,0|2,0,0]=4 3647 B11R1.24 CCNCc1cncc(c1)Cl 207a_100015525214_100000088910 [0,2,0,0,0,0|2,0,0]=4 3648 B11R1.24 CCNCc1cncc(c1)Cl 2230a_100015525214_100016992070 [0,2,0,0,0,0|2,0,0]=4 3649 B11R1.24 CCNCc1cncc(c1)Cl 2230a_200020614424_100000210202 [0,2,0,0,0,0|2,0,0]=4 3650 B11R1.24 CCNCc1cncc(c1)Cl 270004a_100015525214_100000088910 [0,2,0,0,0,0|2,0,0]=4 3651 B11R1.24 CCNCc1cncc(c1)F 207a_100015525214_100011361476 [0,2,0,0,0,0|2,0,0]=4 3652 B11R1.24 CCNCc1cncc(c1)F 2230a_100011962886_100000210202 [0,2,0,0,0,0|2,0,0]=4 3653 B11R1.24 CCNCc1cncc(c1)F 2230a_100015525214_100000725299 [0,2,0,0,0,0|2,0,0]=4 3654 B11R1.24 CCNCc1cncc(c1)F 270004a_100015525214_100011361476 [0,2,0,0,0,0|2,0,0]=4 3655 B11R1.24 CCNCc1cncc(c1)F 34a_100011962886_100000210202 [0,2,0,0,0,0|2,0,0]=4 3656 B11R1.24 CCNCc1cncc(c1)O 207a_100015525214_100012187055 [0,2,0,0,0,0|2,0,0]=4 3657 B11R1.24 CCNCc1cncc(c1)O 270004a_100015525214_100012187055 [0,2,0,0,0,0|2,0,0]=4 3658 B11R1.24 CCNCc1cncc(n1)C 207a_100015525214_100000100294 [0,2,0,0,0,0|1,0,0]=3 3659 B11R1.24 CCNCc1cncc(n1)C 270004a_100015525214_100000100294 [0,2,0,0,0,0|1,0,0]=3 3660 B11R1.24 CCOCc1cc(ccn1)Br 34a_100121572206_100010173614 [0,2,0,0,0,0|2,0,0]=4 3661 B11R1.24 CCOCc1cc(ccn1)C 34a_100011998357_100000210202 [0,2,0,0,0,0|2,0,0]=4 3662 B11R1.24 CCOCc1cc(ccn1)C 34a_100121572206_100000718516 [0,2,0,0,0,0|2,0,0]=4 3663 B11R1.24 CCOCc1cc(ccn1)Cl 34a_100000748867_100000210202 [0,2,0,0,0,0|2,0,0]=4 3664 B11R1.24 CCOCc1cc(ccn1)Cl 34a_100121572206_100016988179 [0,2,0,0,0,0|2,0,0]=4 3665 B11R1.24 CCOCc1cc(ccn1)N 34a_100000692640_100000210202 [0,2,0,0,0,0|2,0,0]=4 3666 B11R1.24 CCOCc1cccc(n1)Br 34a_100000694195_100000210202 [0,2,0,0,0,0|2,0,0]=4 3667 B11R1.24 CCOCc1cccc(n1)Br 34a_100121572206_100009889011 [0,2,0,0,0,0|2,0,0]=4 3668 B11R1.24 CCOCc1cccc(n1)C 34a_100000690600_100000210202 [0,2,0,0,0,0|2,0,0]=4 3669 B11R1.24 CCOCc1cccc(n1)C 34a_100121572206_100000757606 [0,2,0,0,0,0|2,0,0]=4 3670 B11R1.24 CCOCc1cccc(n1)Cl 34a_100011998359_100000210202 [0,2,0,0,0,0|2,0,0]=4 3671 B11R1.24 CCOCc1cccc(n1)Cl 34a_100121572206_100000086093 [0,2,0,0,0,0|2,0,0]=4 3672 B11R1.24 CCOCc1cccc(n1)F 34a_100000086748_100000210202 [0,2,0,0,0,0|2,0,0]=4 3673 B11R1.24 CCOCc1cccc(n1)F 34a_100121572206_100009819644 [0,2,0,0,0,0|2,0,0]=4 3674 B11R1.24 CCOCc1cncc(c1)Br 34a_100011259137_100000210202 [0,2,0,0,0,0|2,0,0]=4 3675 B11R1.24 CCOCc1cncc(c1)Br 34a_100121572206_100000738771 [0,2,0,0,0,0|2,0,0]=4 3676 B11R1.24 CCOCc1cncc(c1)Br 7a_100011259137_100000210202 [0,2,0,0,0,0|2,0,0]=4 3677 B11R1.24 CCOCc1cncc(c1)C 34a_100011998709_100000210202 [0,2,0,0,0,0|2,0,0]=4 3678 B11R1.24 CCOCc1cncc(c1)C 34a_100121572206_100000716715 [0,2,0,0,0,0|2,0,0]=4 3679 B11R1.24 CCOCc1cncc(c1)C 7a_100011998709_100000210202 [0,2,0,0,0,0|2,0,0]=4 3680 B11R1.24 CCOCc1cncc(c1)Cl 34a_100000092867_100000210202 [0,2,0,0,0,0|2,0,0]=4 3681 B11R1.24 CCOCc1cncc(c1)Cl 34a_100121572206_100016992070 [0,2,0,0,0,0|2,0,0]=4 3682 B11R1.24 CCOCc1cncc(c1)Cl 7a_100000092867_100000210202 [0,2,0,0,0,0|2,0,0]=4 3683 B11R1.24 CCOCc1cncc(c1)F 34a_100011962875_100000210202 [0,2,0,0,0,0|2,0,0]=4 3684 B11R1.24 CCOCc1cncc(c1)F 34a_100121572206_100000725299 [0,2,0,0,0,0|2,0,0]=4 3685 B11R1.24 CCOCc1cncc(c1)F 7a_100011962875_100000210202 [0,2,0,0,0,0|2,0,0]=4 3686 B11R1.24 CCOCc1cncc(c1)N 34a_100000085308_100000210202 [0,2,0,0,0,0|2,0,0]=4 3687 B11R1.24 CCSCc1cc(ccn1)Br 62a_100000210202_100010173614 [0,2,0,0,0,0|2,0,0]=4 3688 B11R1.24 CCSCc1cc(ccn1)Br 62a_100010173614_100000210202 [0,2,0,0,0,0|2,0,0]=4 3689 B11R1.24 CCSCc1cc(ccn1)C 62a_100000210202_100000718516 [0,2,0,0,0,0|2,0,0]=4 3690 B11R1.24 CCSCc1cc(ccn1)C 62a_100000718516_100000210202 [0,2,0,0,0,0|2,0,0]=4 3691 B11R1.24 CCSCc1cc(ccn1)Cl 62a_100000210202_100016988179 [0,2,0,0,0,0|2,0,0]=4 3692 B11R1.24 CCSCc1cc(ccn1)Cl 62a_100016988179_100000210202 [0,2,0,0,0,0|2,0,0]=4 3693 B11R1.24 CCSCc1cccc(n1)Br 62a_100000210202_100009889011 [0,2,0,0,0,0|2,0,0]=4 3694 B11R1.24 CCSCc1cccc(n1)Br 62a_100009889011_100000210202 [0,2,0,0,0,0|2,0,0]=4 3695 B11R1.24 CCSCc1cccc(n1)C 62a_100000210202_100000757606 [0,2,0,0,0,0|2,0,0]=4 3696 B11R1.24 CCSCc1cccc(n1)C 62a_100000757606_100000210202 [0,2,0,0,0,0|2,0,0]=4 3697 B11R1.24 CCSCc1cccc(n1)Cl 62a_100000086093_100000210202 [0,2,0,0,0,0|2,0,0]=4 3698 B11R1.24 CCSCc1cccc(n1)Cl 62a_100000210202_100000086093 [0,2,0,0,0,0|2,0,0]=4 3699 B11R1.24 CCSCc1cccc(n1)F 62a_100000210202_100009819644 [0,2,0,0,0,0|2,0,0]=4 3700 B11R1.24 CCSCc1cccc(n1)F 62a_100009819644_100000210202 [0,2,0,0,0,0|2,0,0]=4 3701 B11R1.24 CCSCc1cncc(c1)Br 62a_100000210202_100000738771 [0,2,0,0,0,0|2,0,0]=4 3702 B11R1.24 CCSCc1cncc(c1)Br 62a_100000738771_100000210202 [0,2,0,0,0,0|2,0,0]=4 3703 B11R1.24 CCSCc1cncc(c1)C 62a_100000210202_100000716715 [0,2,0,0,0,0|2,0,0]=4 3704 B11R1.24 CCSCc1cncc(c1)C 62a_100000716715_100000210202 [0,2,0,0,0,0|2,0,0]=4 3705 B11R1.24 CCSCc1cncc(c1)Cl 62a_100000210202_100016992070 [0,2,0,0,0,0|2,0,0]=4 3706 B11R1.24 CCSCc1cncc(c1)Cl 62a_100016992070_100000210202 [0,2,0,0,0,0|2,0,0]=4 3707 B11R1.24 CCSCc1cncc(c1)F 62a_100000210202_100000725299 [0,2,0,0,0,0|2,0,0]=4 3708 B11R1.24 CCSCc1cncc(c1)F 62a_100000725299_100000210202 [0,2,0,0,0,0|2,0,0]=4 3709 B11R1.24 CNCCc1cccc(n1)C 2230a_100011824523_200000210301 [0,2,0,0,0,0|2,0,0]=4 3710 B11R1.24 CNCCc1cccc(n1)C 34a_100011824523_200000210301 [0,2,0,0,0,0|2,0,0]=4 3711 B11R1.24 COCCc1cccc(n1)Br 34a_100010221043_200000210301 [0,2,0,0,0,0|1,1,0]=4 3712 B11R1.24 COCCc1cccc(n1)Br 7a_100010221043_200000210301 [0,2,0,0,0,0|1,1,0]=4 3713 B11R1.24 COCSc1cncc(n1)C 62a_100000754123_100000766300 [0,2,0,0,0,0|1,1,0]=4 3714 B11R1.24 COCSc1cncc(n1)C 62a_100000766300_100000754123 [0,2,0,0,0,0|1,1,0]=4 3715 B11R1.24 COCSc1cncc(n1)Cl 62a_100000766300_100010892449 [0,2,0,0,0,0|1,1,0]=4 3716 B11R1.24 COCSc1cncc(n1)Cl 62a_100010892449_100000766300 [0,2,0,0,0,0|1,1,0]=4 3717 B11R1.24 COCSc1cncc(n1)F 62a_100000766300_200009863489 [0,2,0,0,0,0|1,1,0]=4 3718 B11R1.24 COCSc1cncc(n1)F 62a_200009863489_100000766300 [0,2,0,0,0,0|1,1,0]=4 3719 B11R1.24 COCSc1cncc(n1)N 62a_100000747728_100000766300 [0,2,0,0,0,0|1,1,0]=4 3720 B11R1.24 COCSc1cncc(n1)N 62a_100000766300_100000747728 [0,2,0,0,0,0|1,1,0]=4 3721 B11R1.24 COCSc1cncc(n1)O 62a_100000766300_100011269956 [0,2,0,0,0,0|1,1,0]=4 3722 B11R1.24 CSCCc1cccc(c1)Br 62a_100011740638_200000210301 [0,2,0,0,0,0|2,0,0]=4 3723 B11R1.24 CSCCc1cccc(c1)Br 62a_200000210301_100011740638 [0,2,0,0,0,0|2,0,0]=4 3724 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [0,2,0,0,0,0|2,0,0]=4 3725 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [0,2,0,0,0,0|2,0,0]=4 3726 B11R1.24 CSCCc1cccc(c1)Cl 62a_100011713710_200000210301 [0,2,0,0,0,0|2,0,0]=4 3727 B11R1.24 CSCCc1cccc(c1)Cl 62a_200000210301_100011713710 [0,2,0,0,0,0|2,0,0]=4 3728 B11R1.24 CSCCc1cccc(c1)F 62a_100011217235_200000210301 [0,2,0,0,0,0|2,0,0]=4 3729 B11R1.24 CSCCc1cccc(c1)F 62a_200000210301_100011217235 [0,2,0,0,0,0|2,0,0]=4 3730 B11R1.24 CSCOc1cccc(n1)F 34a_100011432558_100011218213 [0,2,0,0,0,0|2,0,0]=4 3731 B11R1.24 CSCOc1cncc(c1)Br 34a_100000754920_100011218213 [0,2,0,0,0,0|2,0,0]=4 3732 B11R1.24 CSCOc1cncc(c1)C 34a_100011830280_100011218213 [0,2,0,0,0,0|2,0,0]=4 3733 B11R1.24 CSCOc1cncc(c1)F 34a_100011830296_100011218213 [0,2,0,0,0,0|2,0,0]=4 3734 B11R1.24 CSCOc1cncc(c1)N 34a_100011997051_100011218213 [0,2,0,0,0,0|2,0,0]=4 3735 B11R1.24 CSCSc1c[n+](ccn1)[O-] 62a_100011218213_100009880115 [0,2,0,0,0,0|1,0,1]=4 3736 B11R1.24 CSCSc1cc(ccn1)C 62a_100000750283_100011218213 [0,2,0,0,0,0|2,0,0]=4 3737 B11R1.24 CSCSc1cc(ccn1)C 62a_100011218213_100000750283 [0,2,0,0,0,0|2,0,0]=4 3738 B11R1.24 CSCSc1cc(ccn1)Cl 62a_100010167805_100011218213 [0,2,0,0,0,0|2,0,0]=4 3739 B11R1.24 CSCSc1cc(ccn1)Cl 62a_100011218213_100010167805 [0,2,0,0,0,0|2,0,0]=4 3740 B11R1.24 CSCSc1cc(ccn1)F 62a_100000764206_100011218213 [0,2,0,0,0,0|2,0,0]=4 3741 B11R1.24 CSCSc1cc(ccn1)F 62a_100011218213_100000764206 [0,2,0,0,0,0|2,0,0]=4 3742 B11R1.24 CSCSc1cc(ccn1)N 62a_100009814236_100011218213 [0,2,0,0,0,0|2,0,0]=4 3743 B11R1.24 CSCSc1cc(ccn1)N 62a_100011218213_100009814236 [0,2,0,0,0,0|2,0,0]=4 3744 B11R1.24 CSCSc1cc(ccn1)O 62a_100011218213_100000762945 [0,2,0,0,0,0|2,0,0]=4 3745 B11R1.24 CSCSc1cccc(n1)Br 62a_100000684672_100011218213 [0,2,0,0,0,0|2,0,0]=4 3746 B11R1.24 CSCSc1cccc(n1)Br 62a_100011218213_100000684672 [0,2,0,0,0,0|2,0,0]=4 3747 B11R1.24 CSCSc1cccc(n1)C 62a_100000742759_100011218213 [0,2,0,0,0,0|2,0,0]=4 3748 B11R1.24 CSCSc1cccc(n1)C 62a_100011218213_100000742759 [0,2,0,0,0,0|2,0,0]=4 3749 B11R1.24 CSCSc1cccc(n1)Cl 62a_100000051397_100011218213 [0,2,0,0,0,0|2,0,0]=4 3750 B11R1.24 CSCSc1cccc(n1)Cl 62a_100011218213_100000051397 [0,2,0,0,0,0|2,0,0]=4 3751 B11R1.24 CSCSc1cccc(n1)F 62a_100009815982_100011218213 [0,2,0,0,0,0|2,0,0]=4 3752 B11R1.24 CSCSc1cccc(n1)F 62a_100011218213_100009815982 [0,2,0,0,0,0|2,0,0]=4 3753 B11R1.24 CSCSc1cccc(n1)N 62a_100000740741_100011218213 [0,2,0,0,0,0|2,0,0]=4 3754 B11R1.24 CSCSc1cccc(n1)N 62a_100011218213_100000740741 [0,2,0,0,0,0|2,0,0]=4 3755 B11R1.24 CSCSc1cncc(c1)Br 62a_100000728054_100011218213 [0,2,0,0,0,0|2,0,0]=4 3756 B11R1.24 CSCSc1cncc(c1)Br 62a_100011218213_100000728054 [0,2,0,0,0,0|2,0,0]=4 3757 B11R1.24 CSCSc1cncc(c1)C 62a_100000760492_100011218213 [0,2,0,0,0,0|2,0,0]=4 3758 B11R1.24 CSCSc1cncc(c1)C 62a_100011218213_100000760492 [0,2,0,0,0,0|2,0,0]=4 3759 B11R1.24 CSCSc1cncc(c1)Cl 62a_100000049639_100011218213 [0,2,0,0,0,0|2,0,0]=4 3760 B11R1.24 CSCSc1cncc(c1)Cl 62a_100011218213_100000049639 [0,2,0,0,0,0|2,0,0]=4 3761 B11R1.24 CSCSc1cncc(c1)F 62a_100000744099_100011218213 [0,2,0,0,0,0|2,0,0]=4 3762 B11R1.24 CSCSc1cncc(c1)F 62a_100011218213_100000744099 [0,2,0,0,0,0|2,0,0]=4 3763 B11R1.24 CSCSc1cncc(c1)N 62a_100000687067_100011218213 [0,2,0,0,0,0|2,0,0]=4 3764 B11R1.24 CSCSc1cncc(c1)N 62a_100011218213_100000687067 [0,2,0,0,0,0|2,0,0]=4 3765 B11R1.24 CSCSc1cncc(c1)O 62a_100000754920_100011218213 [0,2,0,0,0,0|2,0,0]=4 3766 B11R1.24 CSCSc1cncc(c1)O 62a_100011218213_100000754920 [0,2,0,0,0,0|2,0,0]=4 3767 B11R1.24 CSCSc1cncc(n1)C 62a_100000754123_100011218213 [0,2,0,0,0,0|1,0,0]=3 3768 B11R1.24 CSCSc1cncc(n1)C 62a_100011218213_100000754123 [0,2,0,0,0,0|1,0,0]=3 3769 B11R1.24 CSCSc1cncc(n1)Cl 62a_100010892449_100011218213 [0,2,0,0,0,0|1,0,0]=3 3770 B11R1.24 CSCSc1cncc(n1)Cl 62a_100011218213_100010892449 [0,2,0,0,0,0|1,0,0]=3 3771 B11R1.24 CSCSc1cncc(n1)F 62a_100011218213_200009863489 [0,2,0,0,0,0|1,0,0]=3 3772 B11R1.24 CSCSc1cncc(n1)F 62a_200009863489_100011218213 [0,2,0,0,0,0|1,0,0]=3 3773 B11R1.24 CSCSc1cncc(n1)N 62a_100000747728_100011218213 [0,2,0,0,0,0|1,0,0]=3 3774 B11R1.24 CSCSc1cncc(n1)N 62a_100011218213_100000747728 [0,2,0,0,0,0|1,0,0]=3 3775 B11R1.24 CSCSc1cncc(n1)O 62a_100011218213_100011269956 [0,2,0,0,0,0|1,0,0]=3 3776 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [0,2,0,0,0,0|2,0,0]=4 3777 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [0,2,0,0,0,0|2,0,0]=4 3778 B11R1.24 Cc1cccc(n1)CCN[13CH3] 2230a_100011824523_200025704644 [0,2,0,0,0,0|2,0,0]=4 3779 B11R1.24 Cc1cccc(n1)CCN[13CH3] 34a_100011824523_200025704644 [0,2,0,0,0,0|2,0,0]=4 3780 B11R1.24 Cc1cccc(n1)CNCF 34a_100000701342_100015361967 [0,2,0,0,0,0|2,0,0]=4 3781 B11R1.24 Cc1cccc(n1)COCF 34a_100000690600_100015361967 [0,2,0,0,0,0|2,0,0]=4 3782 B11R1.24 Cc1cccc(n1)CSCF 62a_100000757606_100015361967 [0,2,0,0,0,0|2,0,0]=4 3783 B11R1.24 Cc1cccc(n1)CSCF 62a_100015361967_100000757606 [0,2,0,0,0,0|2,0,0]=4 3784 B11R1.24 Cc1cccc(n1)SCCF 62a_100000742759_100011217306 [0,2,0,0,0,0|2,0,0]=4 3785 B11R1.24 Cc1cccc(n1)SCCF 62a_100011217306_100000742759 [0,2,0,0,0,0|2,0,0]=4 3786 B11R1.24 Cc1cccc(n1)SCCO 62a_100000211926_100000742759 [0,2,0,0,0,0|1,1,0]=4 3787 B11R1.24 Cc1cccc(n1)SCCO 62a_100000742759_100000211926 [0,2,0,0,0,0|1,1,0]=4 3788 B11R1.24 Cc1ccnc(c1)COCF 34a_100011998357_100015361967 [0,2,0,0,0,0|2,0,0]=4 3789 B11R1.24 Cc1ccnc(c1)CSCF 62a_100000718516_100015361967 [0,2,0,0,0,0|2,0,0]=4 3790 B11R1.24 Cc1ccnc(c1)CSCF 62a_100015361967_100000718516 [0,2,0,0,0,0|2,0,0]=4 3791 B11R1.24 Cc1ccnc(c1)SCCF 62a_100000750283_100011217306 [0,2,0,0,0,0|2,0,0]=4 3792 B11R1.24 Cc1ccnc(c1)SCCF 62a_100011217306_100000750283 [0,2,0,0,0,0|2,0,0]=4 3793 B11R1.24 Cc1ccnc(c1)SCCO 62a_100000211926_100000750283 [0,2,0,0,0,0|1,1,0]=4 3794 B11R1.24 Cc1ccnc(c1)SCCO 62a_100000750283_100000211926 [0,2,0,0,0,0|1,1,0]=4 3795 B11R1.24 Cc1cncc(c1)CNCF 34a_100000692839_100015361967 [0,2,0,0,0,0|2,0,0]=4 3796 B11R1.24 Cc1cncc(c1)COCF 34a_100011998709_100015361967 [0,2,0,0,0,0|2,0,0]=4 3797 B11R1.24 Cc1cncc(c1)COCF 7a_100011998709_100015361967 [0,2,0,0,0,0|2,0,0]=4 3798 B11R1.24 Cc1cncc(c1)CSCF 62a_100000716715_100015361967 [0,2,0,0,0,0|2,0,0]=4 3799 B11R1.24 Cc1cncc(c1)CSCF 62a_100015361967_100000716715 [0,2,0,0,0,0|2,0,0]=4 3800 B11R1.24 Cc1cncc(c1)OCCF 34a_100011830280_100011217306 [0,2,0,0,0,0|2,0,0]=4 3801 B11R1.24 Cc1cncc(c1)OCCF 7a_100011830280_100011217306 [0,2,0,0,0,0|2,0,0]=4 3802 B11R1.24 Cc1cncc(c1)OCCO 34a_100011830280_100000211926 [0,2,0,0,0,0|1,1,0]=4 3803 B11R1.24 Cc1cncc(c1)OCCO 7a_100011830280_100000211926 [0,2,0,0,0,0|1,1,0]=4 3804 B11R1.24 Cc1cncc(c1)SCCF 62a_100000760492_100011217306 [0,2,0,0,0,0|2,0,0]=4 3805 B11R1.24 Cc1cncc(c1)SCCF 62a_100011217306_100000760492 [0,2,0,0,0,0|2,0,0]=4 3806 B11R1.24 Cc1cncc(c1)SCCO 62a_100000211926_100000760492 [0,2,0,0,0,0|1,1,0]=4 3807 B11R1.24 Cc1cncc(c1)SCCO 62a_100000760492_100000211926 [0,2,0,0,0,0|1,1,0]=4 3808 B11R1.24 Cc1cncc(n1)NCCO 27a_100000210304_100000754123 [0,2,0,0,0,0|0,1,0]=3 3809 B11R1.24 Cc1cncc(n1)SCC#N 62a_100000754123_100011215382 [0,2,0,0,0,0|1,0,1]=4 3810 B11R1.24 Cc1cncc(n1)SCC#N 62a_100011215382_100000754123 [0,2,0,0,0,0|1,0,1]=4 3811 B11R1.24 Cc1cncc(n1)SCC=O 62a_100000754123_200015260668 [0,2,0,0,0,0|0,1,1]=4 3812 B11R1.24 Cc1cncc(n1)SCC=O 62a_200015260668_100000754123 [0,2,0,0,0,0|0,1,1]=4 3813 B11R1.24 Cc1cncc(n1)SCCF 62a_100000754123_100011217306 [0,2,0,0,0,0|1,0,0]=3 3814 B11R1.24 Cc1cncc(n1)SCCF 62a_100011217306_100000754123 [0,2,0,0,0,0|1,0,0]=3 3815 B11R1.24 Cc1cncc(n1)SCCO 62a_100000211926_100000754123 [0,2,0,0,0,0|0,1,0]=3 3816 B11R1.24 Cc1cncc(n1)SCCO 62a_100000754123_100000211926 [0,2,0,0,0,0|0,1,0]=3 3817 B11R1.24 FCCOc1cccc(n1)F 34a_100011432558_100011217306 [0,2,0,0,0,0|2,0,0]=4 3818 B11R1.24 FCCOc1cncc(c1)Br 34a_100000754920_100011217306 [0,2,0,0,0,0|2,0,0]=4 3819 B11R1.24 FCCOc1cncc(c1)Br 7a_100000754920_100011217306 [0,2,0,0,0,0|2,0,0]=4 3820 B11R1.24 FCCOc1cncc(c1)Cl 7a_100000032511_100011217306 [0,2,0,0,0,0|2,0,0]=4 3821 B11R1.24 FCCOc1cncc(c1)F 34a_100011830296_100011217306 [0,2,0,0,0,0|2,0,0]=4 3822 B11R1.24 FCCOc1cncc(c1)F 7a_100011830296_100011217306 [0,2,0,0,0,0|2,0,0]=4 3823 B11R1.24 FCCSc1cc(ccn1)Cl 62a_100010167805_100011217306 [0,2,0,0,0,0|2,0,0]=4 3824 B11R1.24 FCCSc1cc(ccn1)Cl 62a_100011217306_100010167805 [0,2,0,0,0,0|2,0,0]=4 3825 B11R1.24 FCCSc1cc(ccn1)F 62a_100000764206_100011217306 [0,2,0,0,0,0|2,0,0]=4 3826 B11R1.24 FCCSc1cc(ccn1)F 62a_100011217306_100000764206 [0,2,0,0,0,0|2,0,0]=4 3827 B11R1.24 FCCSc1cccc(n1)Br 62a_100000684672_100011217306 [0,2,0,0,0,0|2,0,0]=4 3828 B11R1.24 FCCSc1cccc(n1)Br 62a_100011217306_100000684672 [0,2,0,0,0,0|2,0,0]=4 3829 B11R1.24 FCCSc1cccc(n1)Cl 62a_100000051397_100011217306 [0,2,0,0,0,0|2,0,0]=4 3830 B11R1.24 FCCSc1cccc(n1)Cl 62a_100011217306_100000051397 [0,2,0,0,0,0|2,0,0]=4 3831 B11R1.24 FCCSc1cccc(n1)F 62a_100009815982_100011217306 [0,2,0,0,0,0|2,0,0]=4 3832 B11R1.24 FCCSc1cccc(n1)F 62a_100011217306_100009815982 [0,2,0,0,0,0|2,0,0]=4 3833 B11R1.24 FCCSc1cncc(c1)Br 62a_100000728054_100011217306 [0,2,0,0,0,0|2,0,0]=4 3834 B11R1.24 FCCSc1cncc(c1)Br 62a_100011217306_100000728054 [0,2,0,0,0,0|2,0,0]=4 3835 B11R1.24 FCCSc1cncc(c1)Cl 62a_100000049639_100011217306 [0,2,0,0,0,0|2,0,0]=4 3836 B11R1.24 FCCSc1cncc(c1)Cl 62a_100011217306_100000049639 [0,2,0,0,0,0|2,0,0]=4 3837 B11R1.24 FCCSc1cncc(c1)F 62a_100000744099_100011217306 [0,2,0,0,0,0|2,0,0]=4 3838 B11R1.24 FCCSc1cncc(c1)F 62a_100011217306_100000744099 [0,2,0,0,0,0|2,0,0]=4 3839 B11R1.24 FCCSc1cncc(n1)Cl 62a_100010892449_100011217306 [0,2,0,0,0,0|1,0,0]=3 3840 B11R1.24 FCCSc1cncc(n1)Cl 62a_100011217306_100010892449 [0,2,0,0,0,0|1,0,0]=3 3841 B11R1.24 FCCSc1cncc(n1)F 62a_100011217306_200009863489 [0,2,0,0,0,0|1,0,0]=3 3842 B11R1.24 FCCSc1cncc(n1)F 62a_200009863489_100011217306 [0,2,0,0,0,0|1,0,0]=3 3843 B11R1.24 FCNCc1cccc(n1)F 34a_100015188798_100015361967 [0,2,0,0,0,0|2,0,0]=4 3844 B11R1.24 FCNCc1cncc(c1)F 34a_100011962886_100015361967 [0,2,0,0,0,0|2,0,0]=4 3845 B11R1.24 FCOCc1cc(ccn1)Cl 34a_100000748867_100015361967 [0,2,0,0,0,0|2,0,0]=4 3846 B11R1.24 FCOCc1cccc(n1)Br 34a_100000694195_100015361967 [0,2,0,0,0,0|2,0,0]=4 3847 B11R1.24 FCOCc1cccc(n1)Cl 34a_100011998359_100015361967 [0,2,0,0,0,0|2,0,0]=4 3848 B11R1.24 FCOCc1cccc(n1)F 34a_100000086748_100015361967 [0,2,0,0,0,0|2,0,0]=4 3849 B11R1.24 FCOCc1cncc(c1)Br 34a_100011259137_100015361967 [0,2,0,0,0,0|2,0,0]=4 3850 B11R1.24 FCOCc1cncc(c1)Br 7a_100011259137_100015361967 [0,2,0,0,0,0|2,0,0]=4 3851 B11R1.24 FCOCc1cncc(c1)Cl 34a_100000092867_100015361967 [0,2,0,0,0,0|2,0,0]=4 3852 B11R1.24 FCOCc1cncc(c1)Cl 7a_100000092867_100015361967 [0,2,0,0,0,0|2,0,0]=4 3853 B11R1.24 FCOCc1cncc(c1)F 34a_100011962875_100015361967 [0,2,0,0,0,0|2,0,0]=4 3854 B11R1.24 FCOCc1cncc(c1)F 7a_100011962875_100015361967 [0,2,0,0,0,0|2,0,0]=4 3855 B11R1.24 FCSCc1cc(ccn1)Br 62a_100010173614_100015361967 [0,2,0,0,0,0|2,0,0]=4 3856 B11R1.24 FCSCc1cc(ccn1)Br 62a_100015361967_100010173614 [0,2,0,0,0,0|2,0,0]=4 3857 B11R1.24 FCSCc1cc(ccn1)Cl 62a_100015361967_100016988179 [0,2,0,0,0,0|2,0,0]=4 3858 B11R1.24 FCSCc1cc(ccn1)Cl 62a_100016988179_100015361967 [0,2,0,0,0,0|2,0,0]=4 3859 B11R1.24 FCSCc1cccc(n1)Br 62a_100009889011_100015361967 [0,2,0,0,0,0|2,0,0]=4 3860 B11R1.24 FCSCc1cccc(n1)Br 62a_100015361967_100009889011 [0,2,0,0,0,0|2,0,0]=4 3861 B11R1.24 FCSCc1cccc(n1)Cl 62a_100000086093_100015361967 [0,2,0,0,0,0|2,0,0]=4 3862 B11R1.24 FCSCc1cccc(n1)Cl 62a_100015361967_100000086093 [0,2,0,0,0,0|2,0,0]=4 3863 B11R1.24 FCSCc1cccc(n1)F 62a_100009819644_100015361967 [0,2,0,0,0,0|2,0,0]=4 3864 B11R1.24 FCSCc1cccc(n1)F 62a_100015361967_100009819644 [0,2,0,0,0,0|2,0,0]=4 3865 B11R1.24 FCSCc1cncc(c1)Br 62a_100000738771_100015361967 [0,2,0,0,0,0|2,0,0]=4 3866 B11R1.24 FCSCc1cncc(c1)Br 62a_100015361967_100000738771 [0,2,0,0,0,0|2,0,0]=4 3867 B11R1.24 FCSCc1cncc(c1)Cl 62a_100015361967_100016992070 [0,2,0,0,0,0|2,0,0]=4 3868 B11R1.24 FCSCc1cncc(c1)Cl 62a_100016992070_100015361967 [0,2,0,0,0,0|2,0,0]=4 3869 B11R1.24 FCSCc1cncc(c1)F 62a_100000725299_100015361967 [0,2,0,0,0,0|2,0,0]=4 3870 B11R1.24 FCSCc1cncc(c1)F 62a_100015361967_100000725299 [0,2,0,0,0,0|2,0,0]=4 3871 B11R1.24 N#CCSc1cncc(n1)Cl 62a_100010892449_100011215382 [0,2,0,0,0,0|1,0,1]=4 3872 B11R1.24 N#CCSc1cncc(n1)Cl 62a_100011215382_100010892449 [0,2,0,0,0,0|1,0,1]=4 3873 B11R1.24 N#CCSc1cncc(n1)F 62a_100011215382_200009863489 [0,2,0,0,0,0|1,0,1]=4 3874 B11R1.24 N#CCSc1cncc(n1)F 62a_200009863489_100011215382 [0,2,0,0,0,0|1,0,1]=4 3875 B11R1.24 N#CCSc1cncc(n1)N 62a_100000747728_100011215382 [0,2,0,0,0,0|1,0,1]=4 3876 B11R1.24 N#CCSc1cncc(n1)N 62a_100011215382_100000747728 [0,2,0,0,0,0|1,0,1]=4 3877 B11R1.24 N#CCSc1cncc(n1)O 62a_100011215382_100011269956 [0,2,0,0,0,0|1,0,1]=4 3878 B11R1.24 Nc1cccc(n1)SCCF 62a_100000740741_100011217306 [0,2,0,0,0,0|2,0,0]=4 3879 B11R1.24 Nc1cccc(n1)SCCF 62a_100011217306_100000740741 [0,2,0,0,0,0|2,0,0]=4 3880 B11R1.24 Nc1cccc(n1)SCCO 62a_100000211926_100000740741 [0,2,0,0,0,0|1,1,0]=4 3881 B11R1.24 Nc1cccc(n1)SCCO 62a_100000740741_100000211926 [0,2,0,0,0,0|1,1,0]=4 3882 B11R1.24 Nc1ccnc(c1)COCF 34a_100000692640_100015361967 [0,2,0,0,0,0|2,0,0]=4 3883 B11R1.24 Nc1ccnc(c1)SCCF 62a_100009814236_100011217306 [0,2,0,0,0,0|2,0,0]=4 3884 B11R1.24 Nc1ccnc(c1)SCCF 62a_100011217306_100009814236 [0,2,0,0,0,0|2,0,0]=4 3885 B11R1.24 Nc1ccnc(c1)SCCO 62a_100000211926_100009814236 [0,2,0,0,0,0|1,1,0]=4 3886 B11R1.24 Nc1ccnc(c1)SCCO 62a_100009814236_100000211926 [0,2,0,0,0,0|1,1,0]=4 3887 B11R1.24 Nc1cncc(c1)COCF 34a_100000085308_100015361967 [0,2,0,0,0,0|2,0,0]=4 3888 B11R1.24 Nc1cncc(c1)OCCF 34a_100011997051_100011217306 [0,2,0,0,0,0|2,0,0]=4 3889 B11R1.24 Nc1cncc(c1)OCCO 34a_100011997051_100000211926 [0,2,0,0,0,0|1,1,0]=4 3890 B11R1.24 Nc1cncc(c1)SCCF 62a_100000687067_100011217306 [0,2,0,0,0,0|2,0,0]=4 3891 B11R1.24 Nc1cncc(c1)SCCF 62a_100011217306_100000687067 [0,2,0,0,0,0|2,0,0]=4 3892 B11R1.24 Nc1cncc(c1)SCCO 62a_100000211926_100000687067 [0,2,0,0,0,0|1,1,0]=4 3893 B11R1.24 Nc1cncc(c1)SCCO 62a_100000687067_100000211926 [0,2,0,0,0,0|1,1,0]=4 3894 B11R1.24 Nc1cncc(n1)SCC=O 62a_100000747728_200015260668 [0,2,0,0,0,0|0,1,1]=4 3895 B11R1.24 Nc1cncc(n1)SCC=O 62a_200015260668_100000747728 [0,2,0,0,0,0|0,1,1]=4 3896 B11R1.24 Nc1cncc(n1)SCCF 62a_100000747728_100011217306 [0,2,0,0,0,0|1,0,0]=3 3897 B11R1.24 Nc1cncc(n1)SCCF 62a_100011217306_100000747728 [0,2,0,0,0,0|1,0,0]=3 3898 B11R1.24 Nc1cncc(n1)SCCO 62a_100000211926_100000747728 [0,2,0,0,0,0|0,1,0]=3 3899 B11R1.24 Nc1cncc(n1)SCCO 62a_100000747728_100000211926 [0,2,0,0,0,0|0,1,0]=3 3900 B11R1.24 O=CCSc1cncc(n1)Cl 62a_100010892449_200015260668 [0,2,0,0,0,0|0,1,1]=4 3901 B11R1.24 O=CCSc1cncc(n1)Cl 62a_200015260668_100010892449 [0,2,0,0,0,0|0,1,1]=4 3902 B11R1.24 O=CCSc1cncc(n1)F 62a_200009863489_200015260668 [0,2,0,0,0,0|0,1,1]=4 3903 B11R1.24 O=CCSc1cncc(n1)F 62a_200015260668_200009863489 [0,2,0,0,0,0|0,1,1]=4 3904 B11R1.24 O=CCSc1cncc(n1)O 62a_200015260668_100011269956 [0,2,0,0,0,0|0,1,1]=4 3905 B11R1.24 OCCNc1cc(ccn1)F 27a_100000210304_100000764206 [0,2,0,0,0,0|1,1,0]=4 3906 B11R1.24 OCCNc1cccc(n1)F 27a_100000210304_100009815982 [0,2,0,0,0,0|1,1,0]=4 3907 B11R1.24 OCCNc1cccc(n1)O 271570a_203496583355_200011880208 [0,2,0,0,0,0|1,1,0]=4 3908 B11R1.24 OCCNc1cncc(n1)Cl 27a_100000210304_100010892449 [0,2,0,0,0,0|0,1,0]=3 3909 B11R1.24 OCCNc1cncc(n1)F 27a_100000210304_200009863489 [0,2,0,0,0,0|0,1,0]=3 3910 B11R1.24 OCCOc1cccc(n1)F 34a_100011432558_100000211926 [0,2,0,0,0,0|1,1,0]=4 3911 B11R1.24 OCCOc1cncc(c1)Br 34a_100000754920_100000211926 [0,2,0,0,0,0|1,1,0]=4 3912 B11R1.24 OCCOc1cncc(c1)Br 7a_100000754920_100000211926 [0,2,0,0,0,0|1,1,0]=4 3913 B11R1.24 OCCOc1cncc(c1)Cl 7a_100000032511_100000211926 [0,2,0,0,0,0|1,1,0]=4 3914 B11R1.24 OCCOc1cncc(c1)F 34a_100011830296_100000211926 [0,2,0,0,0,0|1,1,0]=4 3915 B11R1.24 OCCOc1cncc(c1)F 7a_100011830296_100000211926 [0,2,0,0,0,0|1,1,0]=4 3916 B11R1.24 OCCSc1cc(ccn1)Cl 62a_100000211926_100010167805 [0,2,0,0,0,0|1,1,0]=4 3917 B11R1.24 OCCSc1cc(ccn1)Cl 62a_100010167805_100000211926 [0,2,0,0,0,0|1,1,0]=4 3918 B11R1.24 OCCSc1cc(ccn1)F 62a_100000211926_100000764206 [0,2,0,0,0,0|1,1,0]=4 3919 B11R1.24 OCCSc1cc(ccn1)F 62a_100000764206_100000211926 [0,2,0,0,0,0|1,1,0]=4 3920 B11R1.24 OCCSc1cc(ccn1)O 62a_100000211926_100000762945 [0,2,0,0,0,0|1,1,0]=4 3921 B11R1.24 OCCSc1cccc(n1)Br 62a_100000211926_100000684672 [0,2,0,0,0,0|1,1,0]=4 3922 B11R1.24 OCCSc1cccc(n1)Br 62a_100000684672_100000211926 [0,2,0,0,0,0|1,1,0]=4 3923 B11R1.24 OCCSc1cccc(n1)Cl 62a_100000051397_100000211926 [0,2,0,0,0,0|1,1,0]=4 3924 B11R1.24 OCCSc1cccc(n1)Cl 62a_100000211926_100000051397 [0,2,0,0,0,0|1,1,0]=4 3925 B11R1.24 OCCSc1cccc(n1)F 62a_100000211926_100009815982 [0,2,0,0,0,0|1,1,0]=4 3926 B11R1.24 OCCSc1cccc(n1)F 62a_100009815982_100000211926 [0,2,0,0,0,0|1,1,0]=4 3927 B11R1.24 OCCSc1cncc(c1)Br 62a_100000211926_100000728054 [0,2,0,0,0,0|1,1,0]=4 3928 B11R1.24 OCCSc1cncc(c1)Br 62a_100000728054_100000211926 [0,2,0,0,0,0|1,1,0]=4 3929 B11R1.24 OCCSc1cncc(c1)Cl 62a_100000049639_100000211926 [0,2,0,0,0,0|1,1,0]=4 3930 B11R1.24 OCCSc1cncc(c1)Cl 62a_100000211926_100000049639 [0,2,0,0,0,0|1,1,0]=4 3931 B11R1.24 OCCSc1cncc(c1)F 62a_100000211926_100000744099 [0,2,0,0,0,0|1,1,0]=4 3932 B11R1.24 OCCSc1cncc(c1)F 62a_100000744099_100000211926 [0,2,0,0,0,0|1,1,0]=4 3933 B11R1.24 OCCSc1cncc(c1)O 62a_100000211926_100000754920 [0,2,0,0,0,0|1,1,0]=4 3934 B11R1.24 OCCSc1cncc(c1)O 62a_100000754920_100000211926 [0,2,0,0,0,0|1,1,0]=4 3935 B11R1.24 OCCSc1cncc(n1)Cl 62a_100000211926_100010892449 [0,2,0,0,0,0|0,1,0]=3 3936 B11R1.24 OCCSc1cncc(n1)Cl 62a_100010892449_100000211926 [0,2,0,0,0,0|0,1,0]=3 3937 B11R1.24 OCCSc1cncc(n1)F 62a_100000211926_200009863489 [0,2,0,0,0,0|0,1,0]=3 3938 B11R1.24 OCCSc1cncc(n1)F 62a_200009863489_100000211926 [0,2,0,0,0,0|0,1,0]=3 3939 B11R1.24 OCCSc1cncc(n1)O 62a_100000211926_100011269956 [0,2,0,0,0,0|0,1,0]=3 3940 B11R1.24 Oc1ccnc(c1)SCCF 62a_100011217306_100000762945 [0,2,0,0,0,0|2,0,0]=4 3941 B11R1.24 Oc1cncc(c1)SCCF 62a_100000754920_100011217306 [0,2,0,0,0,0|2,0,0]=4 3942 B11R1.24 Oc1cncc(c1)SCCF 62a_100011217306_100000754920 [0,2,0,0,0,0|2,0,0]=4 3943 B11R1.24 Oc1cncc(n1)SCCF 62a_100011217306_100011269956 [0,2,0,0,0,0|1,0,0]=3 3944 B11R1.24 [13CH3]OCCc1cccc(n1)Br 34a_100010221043_200025704644 [0,2,0,0,0,0|1,1,0]=4 3945 B11R1.24 [13CH3]OCCc1cccc(n1)Br 7a_100010221043_200025704644 [0,2,0,0,0,0|1,1,0]=4 3946 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_100011740638_200025704644 [0,2,0,0,0,0|2,0,0]=4 3947 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_200025704644_100011740638 [0,2,0,0,0,0|2,0,0]=4 3948 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_100011713710_200025704644 [0,2,0,0,0,0|2,0,0]=4 3949 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_200025704644_100011713710 [0,2,0,0,0,0|2,0,0]=4 3950 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_100011217235_200025704644 [0,2,0,0,0,0|2,0,0]=4 3951 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_200025704644_100011217235 [0,2,0,0,0,0|2,0,0]=4 3952 B11R1.24 [O-][n+]1ccnc(c1)NCCO 27a_100000210304_100009880115 [0,2,0,0,0,0|0,1,1]=4 3953 B11R1.24 [O-][n+]1ccnc(c1)SCCF 62a_100011217306_100009880115 [0,2,0,0,0,0|1,0,1]=4 3954 B11R1.24 [O-][n+]1ccnc(c1)SCCO 62a_100000211926_100009880115 [0,2,0,0,0,0|0,1,1]=4 3955 B11R1.157 CC(C)Nc1cncc(n1)Cl 27a_100138425928_100010892449 [0,2,0,0,0,0|2,0,0]=4 3956 B11R1.157 CC(C)Nc1cncc(n1)F 27a_100138425928_200009863489 [0,2,0,0,0,0|2,0,0]=4 3957 B11R1.157 CC(C)Sc1cncc(n1)Cl 62a_100000210206_100010892449 [0,2,0,0,0,0|2,0,0]=4 3958 B11R1.157 CC(C)Sc1cncc(n1)Cl 62a_100010892449_100000210206 [0,2,0,0,0,0|2,0,0]=4 3959 B11R1.157 CC(C)Sc1cncc(n1)F 62a_100000210206_200009863489 [0,2,0,0,0,0|2,0,0]=4 3960 B11R1.157 CC(C)Sc1cncc(n1)F 62a_200009863489_100000210206 [0,2,0,0,0,0|2,0,0]=4 3961 B11R1.157 CC(C)Sc1cncc(n1)N 62a_100000210206_100000747728 [0,2,0,0,0,0|2,0,0]=4 3962 B11R1.157 CC(C)Sc1cncc(n1)N 62a_100000747728_100000210206 [0,2,0,0,0,0|2,0,0]=4 3963 B11R1.157 CC(C)Sc1cncc(n1)O 62a_100000210206_100011269956 [0,2,0,0,0,0|2,0,0]=4 3964 B11R1.157 Cc1cncc(n1)CN(C)C 270004a_100102631434_100000100294 [0,2,0,0,0,0|2,0,0]=4 3965 B11R1.157 Cc1cncc(n1)NC(C)C 27a_100138425928_100000754123 [0,2,0,0,0,0|2,0,0]=4 3966 B11R1.157 Cc1cncc(n1)SC(C)C 62a_100000210206_100000754123 [0,2,0,0,0,0|2,0,0]=4 3967 B11R1.157 Cc1cncc(n1)SC(C)C 62a_100000754123_100000210206 [0,2,0,0,0,0|2,0,0]=4 3968 B11R1.189 C=Cc1cccc(n1)CCO 271570a_100011290941_100010221043 [0,2,0,0,0,0|1,1,0]=4 3969 B11R1.189 C=Cc1cncc(n1)OCC 271570a_100011290941_100000757043 [0,2,0,0,0,0|2,0,0]=4 3970 B11R1.189 CCNc1cncc(n1)C#N 27a_100015525214_100009817212 [0,2,0,0,0,0|2,0,0]=4 3971 B11R1.189 CCNc1cncc(n1)CO 27a_100015525214_100009853123 [0,2,0,0,0,0|2,0,0]=4 3972 B11R1.189 CCNc1cncc(n1)OC 27a_100015525214_100009819700 [0,2,0,0,0,0|2,0,0]=4 3973 B11R1.189 CCOc1cncc(n1)NC 27a_100102657272_100000757043 [0,2,0,0,0,0|2,0,0]=4 3974 B11R1.189 CCOc1cncc(n1)SC 62a_100000757043_200000210301 [0,2,0,0,0,0|2,0,0]=4 3975 B11R1.189 CCOc1cncc(n1)SC 62a_200000210301_100000757043 [0,2,0,0,0,0|2,0,0]=4 3976 B11R1.189 CCOc1cncc(n1)S[13CH3] 62a_100000757043_200025704644 [0,2,0,0,0,0|2,0,0]=4 3977 B11R1.189 CCOc1cncc(n1)S[13CH3] 62a_200025704644_100000757043 [0,2,0,0,0,0|2,0,0]=4 3978 B11R1.189 CCSc1cncc(n1)C#N 62a_100000210202_100009817212 [0,2,0,0,0,0|2,0,0]=4 3979 B11R1.189 CCSc1cncc(n1)CO 62a_100000210202_100009853123 [0,2,0,0,0,0|2,0,0]=4 3980 B11R1.189 CCSc1cncc(n1)CO 62a_100009853123_100000210202 [0,2,0,0,0,0|2,0,0]=4 3981 B11R1.189 CCSc1cncc(n1)NC 62a_100000210202_100011529438 [0,2,0,0,0,0|2,0,0]=4 3982 B11R1.189 CCSc1cncc(n1)NC 62a_100011529438_100000210202 [0,2,0,0,0,0|2,0,0]=4 3983 B11R1.189 CCSc1cncc(n1)NN 62a_100000210202_100102525095 [0,2,0,0,0,0|2,0,0]=4 3984 B11R1.189 CCSc1cncc(n1)NN 62a_100102525095_100000210202 [0,2,0,0,0,0|2,0,0]=4 3985 B11R1.189 CCSc1cncc(n1)OC 62a_100000210202_100000756030 [0,2,0,0,0,0|2,0,0]=4 3986 B11R1.189 CCSc1cncc(n1)OC 62a_100000756030_100000210202 [0,2,0,0,0,0|2,0,0]=4 3987 B11R1.189 CNc1cncc(n1)SCF 62a_100011529438_100015361967 [0,2,0,0,0,0|2,0,0]=4 3988 B11R1.189 CNc1cncc(n1)SCF 62a_100015361967_100011529438 [0,2,0,0,0,0|2,0,0]=4 3989 B11R1.189 COc1cncc(n1)SCF 62a_100000756030_100015361967 [0,2,0,0,0,0|2,0,0]=4 3990 B11R1.189 COc1cncc(n1)SCF 62a_100015361967_100000756030 [0,2,0,0,0,0|2,0,0]=4 3991 B11R1.189 CSc1cccc(n1)CCO 62a_100010221043_200000210301 [0,2,0,0,0,0|1,1,0]=4 3992 B11R1.189 CSc1cccc(n1)CCO 62a_200000210301_100010221043 [0,2,0,0,0,0|1,1,0]=4 3993 B11R1.189 N#Cc1cncc(n1)SCF 62a_100015361967_100009817212 [0,2,0,0,0,0|2,0,0]=4 3994 B11R1.189 NNc1cncc(n1)SCF 62a_100015361967_100102525095 [0,2,0,0,0,0|2,0,0]=4 3995 B11R1.189 NNc1cncc(n1)SCF 62a_100102525095_100015361967 [0,2,0,0,0,0|2,0,0]=4 3996 B11R1.189 OCc1cncc(n1)SCF 62a_100009853123_100015361967 [0,2,0,0,0,0|2,0,0]=4 3997 B11R1.189 OCc1cncc(n1)SCF 62a_100015361967_100009853123 [0,2,0,0,0,0|2,0,0]=4 3998 B11R1.189 [13CH3]Sc1cccc(n1)CCO 62a_100010221043_200025704644 [0,2,0,0,0,0|1,1,0]=4 3999 B11R1.189 [13CH3]Sc1cccc(n1)CCO 62a_200025704644_100010221043 [0,2,0,0,0,0|1,1,0]=4 4000 B11R1.12 CCC(NC)c1ccccn1 2230a_100015186561_200000210301 [0,2,0,0,0,0|2,0,0]=4 4001 B11R1.12 CCC(NC)c1ccccn1 269862a_106832991636_100000748178 [0,2,0,0,0,0|2,0,0]=4 4002 B11R1.12 CCC(NC)c1cccnc1 2230a_100000246009_200000210301 [0,2,0,0,0,0|2,0,0]=4 4003 B11R1.12 CCC(NC)c1cccnc1 269862a_106832991636_100011218761 [0,2,0,0,0,0|2,0,0]=4 4004 B11R1.12 CCC(NC)c1cnccn1 2230a_200016994365_200000210301 [0,2,0,0,0,0|1,0,0]=3 4005 B11R1.12 CCC(N[13CH3])c1ccccn1 2230a_100015186561_200025704644 [0,2,0,0,0,0|2,0,0]=4 4006 B11R1.12 CCC(N[13CH3])c1cccnc1 2230a_100000246009_200025704644 [0,2,0,0,0,0|2,0,0]=4 4007 B11R1.12 CCC(N[13CH3])c1cnccn1 2230a_200016994365_200025704644 [0,2,0,0,0,0|1,0,0]=3 4008 B11R1.12 CCN(CC)c1cnccn1 27a_100000724800_100000211759 [0,2,0,0,0,0|2,0,0]=4 4009 B11R1.12 CNC(CO)c1ccccn1 2230a_100015196888_200000210301 [0,2,0,0,0,0|1,1,0]=4 4010 B11R1.12 [13CH3]NC(CO)c1ccccn1 2230a_100015196888_200025704644 [0,2,0,0,0,0|1,1,0]=4 4011 B11R1.16 C#CCN(C)c1cnccn1 27a_100000225692_100000211759 [0,2,0,0,0,0|1,0,1]=4 4012 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [0,2,0,0,0,0|2,0,0]=4 4013 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [0,2,0,0,0,0|2,0,0]=4 4014 B11R1.16 CC(SCF)c1cnccn1 62a_100015361967_200000703233 [0,2,0,0,0,0|1,0,0]=3 4015 B11R1.16 CC(SCF)c1cnccn1 62a_200000703233_100015361967 [0,2,0,0,0,0|1,0,0]=3 4016 B11R1.16 CCCN(C)c1cnccn1 27a_100000747261_100000211759 [0,2,0,0,0,0|1,0,0]=3 4017 B11R1.16 CCNC(C)c1ccccn1 2230a_100000181244_100000210202 [0,2,0,0,0,0|2,0,0]=4 4018 B11R1.16 CCNC(C)c1ccccn1 269862a_100015525214_100000210467 [0,2,0,0,0,0|2,0,0]=4 4019 B11R1.16 CCNC(C)c1cccnc1 2230a_100000195435_100000210202 [0,2,0,0,0,0|2,0,0]=4 4020 B11R1.16 CCNC(C)c1cccnc1 269862a_100015525214_100000210468 [0,2,0,0,0,0|2,0,0]=4 4021 B11R1.16 CCNC(C)c1cnccn1 2230a_100015525214_200000703233 [0,2,0,0,0,0|1,0,0]=3 4022 B11R1.16 CCNC(C)c1cnccn1 269862a_100015525214_100000751083 [0,2,0,0,0,0|1,0,0]=3 4023 B11R1.16 CCN[C@H](C)c1cnccn1 2230a_100020589798_100000210202 [0,2,0,0,0,0|1,0,0]=3 4024 B11R1.16 CCSC(C)c1cnccn1 62a_100000210202_200000703233 [0,2,0,0,0,0|1,0,0]=3 4025 B11R1.16 CCSC(C)c1cnccn1 62a_200000703233_100000210202 [0,2,0,0,0,0|1,0,0]=3 4026 B11R1.16 CN(CCO)c1cnccn1 27a_100000210263_100000211759 [0,2,0,0,0,0|0,1,0]=3 4027 B11R1.16 CNCC(O)c1ccccn1 2230a_100000691469_200000210301 [0,2,0,0,0,0|2,0,0]=4 4028 B11R1.16 CNCC(O)c1cccnc1 2230a_100020605170_200000210301 [0,2,0,0,0,0|2,0,0]=4 4029 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [0,2,0,0,0,0|1,0,1]=4 4030 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [0,2,0,0,0,0|1,0,1]=4 4031 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [0,2,0,0,0,0|1,0,1]=4 4032 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [0,2,0,0,0,0|1,0,1]=4 4033 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [0,2,0,0,0,0|2,0,0]=4 4034 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [0,2,0,0,0,0|2,0,0]=4 4035 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [0,2,0,0,0,0|2,0,0]=4 4036 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [0,2,0,0,0,0|2,0,0]=4 4037 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [0,2,0,0,0,0|2,0,0]=4 4038 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [0,2,0,0,0,0|2,0,0]=4 4039 B11R1.16 [13CH3]NCC(O)c1ccccn1 2230a_100000691469_200025704644 [0,2,0,0,0,0|2,0,0]=4 4040 B11R1.16 [13CH3]NCC(O)c1cccnc1 2230a_100020605170_200025704644 [0,2,0,0,0,0|2,0,0]=4 4041 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [0,2,0,0,0,0|1,0,1]=4 4042 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [0,2,0,0,0,0|1,0,1]=4 4043 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [0,2,0,0,0,0|1,0,1]=4 4044 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [0,2,0,0,0,0|1,0,1]=4 4045 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [0,2,0,0,0,0|2,0,0]=4 4046 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [0,2,0,0,0,0|2,0,0]=4 4047 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [0,2,0,0,0,0|2,0,0]=4 4048 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [0,2,0,0,0,0|2,0,0]=4 4049 B11R1.36 CC(=O)C(C)c1cnccn1 1458a_100000070787_200000703233 [0,2,0,0,0,0|0,1,1]=4 4050 B11R1.36 CC(C)N(C)c1cnccn1 27a_200000211004_100000211759 [0,2,0,0,0,0|2,0,0]=4 4051 B11R1.36 CC(c1cnccn1)N(C)C 2230a_100102631434_200000703233 [0,2,0,0,0,0|2,0,0]=4 4052 B11R1.36 CC(c1cnccn1)N(C)C 269982a_100102631434_200000703233 [0,2,0,0,0,0|2,0,0]=4 4053 B11R1.28 BrCCOCc1ccccn1 34a_100000211926_100000721315 [0,2,0,0,0,0|2,0,0]=4 4054 B11R1.28 BrCCOCc1cccnc1 34a_100000211926_100000733263 [0,2,0,0,0,0|2,0,0]=4 4055 B11R1.28 BrCCOCc1cnccn1 34a_100000211926_100016995436 [0,2,0,0,0,0|1,0,0]=3 4056 B11R1.28 C#CCCNc1cnccn1 27a_100000755551_100000211759 [0,2,0,0,0,0|1,0,0]=3 4057 B11R1.28 C#CCCOc1cccnc1 34a_100000210849_100000688953 [0,2,0,0,0,0|2,0,0]=4 4058 B11R1.28 C#CCCOc1cccnc1 7a_100000210849_100000688953 [0,2,0,0,0,0|2,0,0]=4 4059 B11R1.28 C#CCCSc1ccccn1 62a_100000688953_100011216584 [0,2,0,0,0,0|2,0,0]=4 4060 B11R1.28 C#CCCSc1ccccn1 62a_100011216584_100000688953 [0,2,0,0,0,0|2,0,0]=4 4061 B11R1.28 C#CCCSc1cccnc1 62a_100000210063_100000688953 [0,2,0,0,0,0|2,0,0]=4 4062 B11R1.28 C#CCCSc1cccnc1 62a_100000688953_100000210063 [0,2,0,0,0,0|2,0,0]=4 4063 B11R1.28 C#CCCSc1cnccn1 62a_100000211759_100000688953 [0,2,0,0,0,0|1,0,0]=3 4064 B11R1.28 C#CCCSc1cnccn1 62a_100000688953_100000211759 [0,2,0,0,0,0|1,0,0]=3 4065 B11R1.28 C#CCNCc1ccccn1 34a_100000212058_100000721315 [0,2,0,0,0,0|2,0,0]=4 4066 B11R1.28 C#CCNCc1cccnc1 34a_100000212058_100000733263 [0,2,0,0,0,0|2,0,0]=4 4067 B11R1.28 C#CCNCc1cnccn1 34a_100000212058_100016995436 [0,2,0,0,0,0|1,0,0]=3 4068 B11R1.28 C#CCOCc1ccccn1 34a_100000210247_100000721315 [0,2,0,0,0,0|2,0,0]=4 4069 B11R1.28 C#CCOCc1cccnc1 34a_100000210247_100000733263 [0,2,0,0,0,0|2,0,0]=4 4070 B11R1.28 C#CCOCc1cnccn1 34a_100000210247_100016995436 [0,2,0,0,0,0|1,0,0]=3 4071 B11R1.28 C#CCSCc1ccccn1 62a_100000038162_100000721315 [0,2,0,0,0,0|2,0,0]=4 4072 B11R1.28 C#CCSCc1cccnc1 62a_100000038162_100000741622 [0,2,0,0,0,0|2,0,0]=4 4073 B11R1.28 C#CCSCc1cnccn1 62a_100000038162_100016995436 [0,2,0,0,0,0|1,0,0]=3 4074 B11R1.28 C/C=C/CSc1cnccn1 62a_100000211759_100102629194 [0,2,0,0,0,0|1,0,1]=4 4075 B11R1.28 C/C=C/CSc1cnccn1 62a_100102629194_100000211759 [0,2,0,0,0,0|1,0,1]=4 4076 B11R1.28 C=CCCNc1cnccn1 27a_100015191253_100000211759 [0,2,0,0,0,0|1,0,0]=3 4077 B11R1.28 C=CCCOc1cccnc1 34a_100000210849_100000754431 [0,2,0,0,0,0|2,0,0]=4 4078 B11R1.28 C=CCCOc1cccnc1 7a_100000210849_100000754431 [0,2,0,0,0,0|2,0,0]=4 4079 B11R1.28 C=CCCSc1ccccn1 62a_100000754431_100011216584 [0,2,0,0,0,0|2,0,0]=4 4080 B11R1.28 C=CCCSc1ccccn1 62a_100011216584_100000754431 [0,2,0,0,0,0|2,0,0]=4 4081 B11R1.28 C=CCCSc1cccnc1 62a_100000210063_100000754431 [0,2,0,0,0,0|2,0,0]=4 4082 B11R1.28 C=CCCSc1cccnc1 62a_100000754431_100000210063 [0,2,0,0,0,0|2,0,0]=4 4083 B11R1.28 C=CCCSc1cnccn1 62a_100000211759_100000754431 [0,2,0,0,0,0|1,0,0]=3 4084 B11R1.28 C=CCCSc1cnccn1 62a_100000754431_100000211759 [0,2,0,0,0,0|1,0,0]=3 4085 B11R1.28 C=CCNCc1ccccn1 2230a_100020586998_100000721315 [0,2,0,0,0,0|2,0,0]=4 4086 B11R1.28 C=CCNCc1ccccn1 270004a_100020586998_100000209966 [0,2,0,0,0,0|2,0,0]=4 4087 B11R1.28 C=CCNCc1cccnc1 2230a_100020586998_100000741622 [0,2,0,0,0,0|2,0,0]=4 4088 B11R1.28 C=CCNCc1cccnc1 270004a_100020586998_100000209961 [0,2,0,0,0,0|2,0,0]=4 4089 B11R1.28 C=CCNCc1cnccn1 2230a_100020586998_100016995436 [0,2,0,0,0,0|1,0,0]=3 4090 B11R1.28 C=CCNCc1cnccn1 270004a_100020586998_100000749867 [0,2,0,0,0,0|1,0,0]=3 4091 B11R1.28 C=CCOCc1ccccn1 34a_200000210373_100000721315 [0,2,0,0,0,0|2,0,0]=4 4092 B11R1.28 C=CCOCc1cccnc1 34a_200000210373_100000733263 [0,2,0,0,0,0|2,0,0]=4 4093 B11R1.28 C=CCOCc1cnccn1 34a_200000210373_100016995436 [0,2,0,0,0,0|1,0,0]=3 4094 B11R1.28 C=CCSCc1ccccn1 62a_100000210623_100000721315 [0,2,0,0,0,0|2,0,0]=4 4095 B11R1.28 C=CCSCc1ccccn1 62a_100000721315_100000210623 [0,2,0,0,0,0|2,0,0]=4 4096 B11R1.28 C=CCSCc1cccnc1 62a_100000210623_100000741622 [0,2,0,0,0,0|2,0,0]=4 4097 B11R1.28 C=CCSCc1cccnc1 62a_100000741622_100000210623 [0,2,0,0,0,0|2,0,0]=4 4098 B11R1.28 C=CCSCc1cnccn1 62a_100000210623_100016995436 [0,2,0,0,0,0|1,0,0]=3 4099 B11R1.28 C=CCSCc1cnccn1 62a_100016995436_100000210623 [0,2,0,0,0,0|1,0,0]=3 4100 B11R1.28 CC#CCNc1cnccn1 27a_100000685387_100000211759 [0,2,0,0,0,0|1,0,1]=4 4101 B11R1.28 CC#CCSc1cnccn1 62a_100000211759_100000748600 [0,2,0,0,0,0|1,0,1]=4 4102 B11R1.28 CC#CCSc1cnccn1 62a_100000748600_100000211759 [0,2,0,0,0,0|1,0,1]=4 4103 B11R1.28 CC=CCSc1cnccn1 62a_100000070051_100000211759 [0,2,0,0,0,0|1,0,1]=4 4104 B11R1.28 CC=CCSc1cnccn1 62a_100000211759_100000070051 [0,2,0,0,0,0|1,0,1]=4 4105 B11R1.28 CCC=NNc1cnccn1 4a_100000736894_100000210100 [0,2,0,0,0,0|1,0,1]=4 4106 B11R1.28 CCCC=Cc1ccccn1 271570a_100016258520_100011216584 [0,2,0,0,0,0|2,0,0]=4 4107 B11R1.28 CCCC=Cc1cccnc1 271570a_100016258520_100000752921 [0,2,0,0,0,0|2,0,0]=4 4108 B11R1.28 CCCC=Cc1cnccn1 271570a_100016258520_100000758340 [0,2,0,0,0,0|1,0,0]=3 4109 B11R1.28 CCCCNc1cnccn1 27a_100000102301_100000211759 [0,2,0,0,0,0|1,0,0]=3 4110 B11R1.28 CCCCOc1cccnc1 34a_100000210849_100000210210 [0,2,0,0,0,0|2,0,0]=4 4111 B11R1.28 CCCCOc1cccnc1 7a_100000210849_100000210211 [0,2,0,0,0,0|2,0,0]=4 4112 B11R1.28 CCCCSc1ccccn1 62a_100000210211_100011216584 [0,2,0,0,0,0|2,0,0]=4 4113 B11R1.28 CCCCSc1ccccn1 62a_100011216584_100000210210 [0,2,0,0,0,0|2,0,0]=4 4114 B11R1.28 CCCCSc1cccnc1 62a_100000210063_100000210210 [0,2,0,0,0,0|2,0,0]=4 4115 B11R1.28 CCCCSc1cccnc1 62a_100000210211_100000210063 [0,2,0,0,0,0|2,0,0]=4 4116 B11R1.28 CCCCSc1cnccn1 62a_100000210211_100000211759 [0,2,0,0,0,0|1,0,0]=3 4117 B11R1.28 CCCCSc1cnccn1 62a_100000211759_100000210210 [0,2,0,0,0,0|1,0,0]=3 4118 B11R1.28 CCCNCc1ccccn1 207a_100020643023_100000209966 [0,2,0,0,0,0|2,0,0]=4 4119 B11R1.28 CCCNCc1ccccn1 270004a_100020643023_100000209966 [0,2,0,0,0,0|2,0,0]=4 4120 B11R1.28 CCCNCc1cccnc1 207a_100020643023_100000209961 [0,2,0,0,0,0|2,0,0]=4 4121 B11R1.28 CCCNCc1cccnc1 270004a_100020643023_100000209961 [0,2,0,0,0,0|2,0,0]=4 4122 B11R1.28 CCCNCc1cnccn1 270004a_100020643023_100000749867 [0,2,0,0,0,0|1,0,0]=3 4123 B11R1.28 CCCOCc1ccccn1 34a_100000210258_100000721315 [0,2,0,0,0,0|2,0,0]=4 4124 B11R1.28 CCCOCc1cccnc1 34a_100000210258_100000733263 [0,2,0,0,0,0|2,0,0]=4 4125 B11R1.28 CCCOCc1cnccn1 34a_100000210258_100016995436 [0,2,0,0,0,0|1,0,0]=3 4126 B11R1.28 CCCSCc1ccccn1 62a_100000210303_100000721315 [0,2,0,0,0,0|2,0,0]=4 4127 B11R1.28 CCCSCc1ccccn1 62a_100000721315_100000210303 [0,2,0,0,0,0|2,0,0]=4 4128 B11R1.28 CCCSCc1cccnc1 62a_100000210303_100000741622 [0,2,0,0,0,0|2,0,0]=4 4129 B11R1.28 CCCSCc1cccnc1 62a_100000741622_100000210303 [0,2,0,0,0,0|2,0,0]=4 4130 B11R1.28 CCCSCc1cnccn1 62a_100000210303_100016995436 [0,2,0,0,0,0|1,0,0]=3 4131 B11R1.28 CCCSCc1cnccn1 62a_100016995436_100000210303 [0,2,0,0,0,0|1,0,0]=3 4132 B11R1.28 CCNCCc1ccccn1 2230a_100015525214_100015183660 [0,2,0,0,0,0|2,0,0]=4 4133 B11R1.28 CCNCCc1cccnc1 2230a_100000736294_100000210202 [0,2,0,0,0,0|2,0,0]=4 4134 B11R1.28 CCNCCc1cccnc1 2230a_100015525214_200011713674 [0,2,0,0,0,0|2,0,0]=4 4135 B11R1.28 CCNN=Cc1cnccn1 4a_100000756455_100000749867 [0,2,0,0,0,0|1,0,1]=4 4136 B11R1.28 CCOC=Cc1cnccn1 271570a_100016256518_100000758340 [0,2,0,0,0,0|1,0,1]=4 4137 B11R1.28 CCOCCc1ccccn1 34a_100000210271_100000210202 [0,2,0,0,0,0|1,1,0]=4 4138 B11R1.28 CCOCCc1cccnc1 34a_100011217484_100000210202 [0,2,0,0,0,0|1,1,0]=4 4139 B11R1.28 CCOCCc1cnccn1 34a_100011349526_100000210202 [0,2,0,0,0,0|0,1,0]=3 4140 B11R1.28 CCOCSc1ccccn1 62a_100000739092_100011216584 [0,2,0,0,0,0|2,0,0]=4 4141 B11R1.28 CCOCSc1ccccn1 62a_100011216584_100000739092 [0,2,0,0,0,0|2,0,0]=4 4142 B11R1.28 CCOCSc1cccnc1 62a_100000210063_100000739092 [0,2,0,0,0,0|2,0,0]=4 4143 B11R1.28 CCOCSc1cccnc1 62a_100000739092_100000210063 [0,2,0,0,0,0|2,0,0]=4 4144 B11R1.28 CCOCSc1cnccn1 62a_100000211759_100000739092 [0,2,0,0,0,0|1,0,0]=3 4145 B11R1.28 CCOCSc1cnccn1 62a_100000739092_100000211759 [0,2,0,0,0,0|1,0,0]=3 4146 B11R1.28 CCSCCc1ccccc1 62a_100000210202_100011218657 [0,2,0,0,0,0|2,0,0]=4 4147 B11R1.28 CCSCCc1ccccc1 62a_100000765856_100000210202 [0,2,0,0,0,0|2,0,0]=4 4148 B11R1.28 CCSCCc1ccccn1 62a_100000210202_100015183660 [0,2,0,0,0,0|1,0,0]=3 4149 B11R1.28 CCSCCc1ccccn1 62a_100015183660_100000210202 [0,2,0,0,0,0|1,0,0]=3 4150 B11R1.28 CCSCCc1cccnc1 62a_100000210202_200011713674 [0,2,0,0,0,0|1,0,0]=3 4151 B11R1.28 CCSCCc1cccnc1 62a_200011713674_100000210202 [0,2,0,0,0,0|1,0,0]=3 4152 B11R1.28 CNCCCc1cccnc1 2230a_100011532358_200000210301 [0,2,0,0,0,0|2,0,0]=4 4153 B11R1.28 CNCCCc1cccnc1 34a_100011532358_200000210301 [0,2,0,0,0,0|2,0,0]=4 4154 B11R1.28 CNCCOc1ccccn1 2230a_106741647558_200000210301 [0,2,0,0,0,0|2,0,0]=4 4155 B11R1.28 CNCCOc1cccnc1 2230a_100000754688_200000210301 [0,2,0,0,0,0|2,0,0]=4 4156 B11R1.28 COCC=Cc1cnccn1 271570a_100016286323_100000758340 [0,2,0,0,0,0|0,1,1]=4 4157 B11R1.28 COCCCc1ccccn1 34a_100011215068_200000210301 [0,2,0,0,0,0|1,1,0]=4 4158 B11R1.28 COCCCc1cccnc1 34a_100000211284_200000210301 [0,2,0,0,0,0|1,1,0]=4 4159 B11R1.28 COCCNc1cnccn1 27a_100000209980_100000211759 [0,2,0,0,0,0|0,1,0]=3 4160 B11R1.28 COCCOc1cccnc1 34a_100000210849_100011201679 [0,2,0,0,0,0|1,1,0]=4 4161 B11R1.28 COCCOc1cccnc1 7a_100000210849_100000233755 [0,2,0,0,0,0|1,1,0]=4 4162 B11R1.28 COCCSc1ccccn1 62a_100000233755_100011216584 [0,2,0,0,0,0|1,1,0]=4 4163 B11R1.28 COCCSc1ccccn1 62a_100011216584_100000233755 [0,2,0,0,0,0|1,1,0]=4 4164 B11R1.28 COCCSc1ccccn1 7a_100000156319_200000210301 [0,2,0,0,0,0|1,1,0]=4 4165 B11R1.28 COCCSc1cccnc1 62a_100000210063_100000233755 [0,2,0,0,0,0|1,1,0]=4 4166 B11R1.28 COCCSc1cccnc1 62a_100000233755_100000210063 [0,2,0,0,0,0|1,1,0]=4 4167 B11R1.28 COCCSc1cnccn1 62a_100000211759_100000233755 [0,2,0,0,0,0|0,1,0]=3 4168 B11R1.28 COCCSc1cnccn1 62a_100000233755_100000211759 [0,2,0,0,0,0|0,1,0]=3 4169 B11R1.28 COCSCc1ccccn1 62a_100000721315_100000766300 [0,2,0,0,0,0|1,1,0]=4 4170 B11R1.28 COCSCc1ccccn1 62a_100000766300_100000721315 [0,2,0,0,0,0|1,1,0]=4 4171 B11R1.28 COCSCc1cccnc1 62a_100000741622_100000766300 [0,2,0,0,0,0|1,1,0]=4 4172 B11R1.28 COCSCc1cccnc1 62a_100000766300_100000741622 [0,2,0,0,0,0|1,1,0]=4 4173 B11R1.28 COCSCc1cnccn1 62a_100000766300_100016995436 [0,2,0,0,0,0|0,1,0]=3 4174 B11R1.28 COCSCc1cnccn1 62a_100016995436_100000766300 [0,2,0,0,0,0|0,1,0]=3 4175 B11R1.28 CSCCCc1ccccc1 62a_100000211621_200000210301 [0,2,0,0,0,0|2,0,0]=4 4176 B11R1.28 CSCCCc1ccccc1 62a_200000210301_100000211621 [0,2,0,0,0,0|2,0,0]=4 4177 B11R1.28 CSCCNc1ccccc1 34a_100000106764_100000212216 [0,2,0,0,0,0|2,0,0]=4 4178 B11R1.28 CSCCNc1cccnn1 27a_100020590264_100016991348 [0,2,0,0,0,0|2,0,0]=4 4179 B11R1.28 CSCCNc1ccncn1 27a_100020590264_100000703185 [0,2,0,0,0,0|2,0,0]=4 4180 B11R1.28 CSCCNc1cnccn1 27a_100020590264_100000211759 [0,2,0,0,0,0|0,0,0]=2 4181 B11R1.28 CSCCNc1ncccn1 27a_100020590264_100000211032 [0,2,0,0,0,0|2,0,0]=4 4182 B11R1.28 CSCCOc1ccccc1 34a_100000210340_100000212216 [0,2,0,0,0,0|2,0,0]=4 4183 B11R1.28 CSCCOc1ccccc1 62a_100000184471_200000210301 [0,2,0,0,0,0|2,0,0]=4 4184 B11R1.28 CSCCOc1ccccc1 62a_200000210301_100000184471 [0,2,0,0,0,0|2,0,0]=4 4185 B11R1.28 CSCCOc1ccccc1 7a_100000210340_100000212216 [0,2,0,0,0,0|2,0,0]=4 4186 B11R1.28 CSCCOc1cccnc1 34a_100000210849_100000212216 [0,2,0,0,0,0|1,0,0]=3 4187 B11R1.28 CSCCOc1cccnc1 7a_100000210849_100000212216 [0,2,0,0,0,0|1,0,0]=3 4188 B11R1.28 CSCCOc1ccnnc1 34a_100015204005_100000212216 [0,2,0,0,0,0|2,0,0]=4 4189 B11R1.28 CSCCOc1cncnc1 7a_100000754086_100000212216 [0,2,0,0,0,0|2,0,0]=4 4190 B11R1.28 CSCCSc1ccccc1 62a_100000212216_100000041952 [0,2,0,0,0,0|2,0,0]=4 4191 B11R1.28 CSCCSc1ccccc1 62a_100000246102_200000210301 [0,2,0,0,0,0|2,0,0]=4 4192 B11R1.28 CSCCSc1ccccc1 62a_100000719477_100000751147 [0,2,0,0,0,0|2,0,0]=4 4193 B11R1.28 CSCCSc1ccccc1 62a_200000210301_100000246102 [0,2,0,0,0,0|2,0,0]=4 4194 B11R1.28 CSCCSc1ccccn1 62a_100000212216_100011216584 [0,2,0,0,0,0|1,0,0]=3 4195 B11R1.28 CSCCSc1ccccn1 62a_100011216584_100000751147 [0,2,0,0,0,0|1,0,0]=3 4196 B11R1.28 CSCCSc1cccnc1 62a_100000210063_100000751147 [0,2,0,0,0,0|1,0,0]=3 4197 B11R1.28 CSCCSc1cccnc1 62a_100000212216_100000210063 [0,2,0,0,0,0|1,0,0]=3 4198 B11R1.28 CSCCSc1cccnn1 62a_100000212216_100016991348 [0,2,0,0,0,0|2,0,0]=4 4199 B11R1.28 CSCCSc1cccnn1 62a_100016991348_100000751147 [0,2,0,0,0,0|2,0,0]=4 4200 B11R1.28 CSCCSc1ccncn1 62a_100000212216_100000703185 [0,2,0,0,0,0|2,0,0]=4 4201 B11R1.28 CSCCSc1ccncn1 62a_100000703185_100000751147 [0,2,0,0,0,0|2,0,0]=4 4202 B11R1.28 CSCCSc1ccnnc1 62a_100000212216_100000732662 [0,2,0,0,0,0|2,0,0]=4 4203 B11R1.28 CSCCSc1ccnnc1 62a_100000732662_100000751147 [0,2,0,0,0,0|2,0,0]=4 4204 B11R1.28 CSCCSc1cnccn1 62a_100000211759_100000751147 [0,2,0,0,0,0|0,0,0]=2 4205 B11R1.28 CSCCSc1cnccn1 62a_100000212216_100000211759 [0,2,0,0,0,0|0,0,0]=2 4206 B11R1.28 CSCCSc1cncnc1 62a_100000212216_100011206942 [0,2,0,0,0,0|2,0,0]=4 4207 B11R1.28 CSCCSc1cncnc1 62a_100011206942_100000751147 [0,2,0,0,0,0|2,0,0]=4 4208 B11R1.28 CSCCSc1ncccn1 62a_100000211032_100000751147 [0,2,0,0,0,0|2,0,0]=4 4209 B11R1.28 CSCCSc1ncccn1 62a_100000212216_100000211032 [0,2,0,0,0,0|2,0,0]=4 4210 B11R1.28 CSCNCc1ccccc1 2230a_100015324214_100011218213 [0,2,0,0,0,0|2,0,0]=4 4211 B11R1.28 CSCNCc1ccccc1 34a_100015324214_100011218213 [0,2,0,0,0,0|2,0,0]=4 4212 B11R1.28 CSCNCc1cccnn1 2230a_100159270163_100011218213 [0,2,0,0,0,0|2,0,0]=4 4213 B11R1.28 CSCNCc1cncnc1 2230a_100011243677_100011218213 [0,2,0,0,0,0|2,0,0]=4 4214 B11R1.28 CSCOCc1ccccc1 34a_100000210790_100011218213 [0,2,0,0,0,0|2,0,0]=4 4215 B11R1.28 CSCOCc1ccccc1 62a_100000763385_200000210301 [0,2,0,0,0,0|2,0,0]=4 4216 B11R1.28 CSCOCc1ccccc1 62a_200000210301_100000763385 [0,2,0,0,0,0|2,0,0]=4 4217 B11R1.28 CSCSCc1ccccc1 62a_100000211182_100011218213 [0,2,0,0,0,0|2,0,0]=4 4218 B11R1.28 CSCSCc1ccccc1 62a_100011218213_100015291786 [0,2,0,0,0,0|2,0,0]=4 4219 B11R1.28 CSCSCc1ccccc1 62a_200000210301_200011217039 [0,2,0,0,0,0|2,0,0]=4 4220 B11R1.28 CSCSCc1ccccc1 62a_200011217039_200000210301 [0,2,0,0,0,0|2,0,0]=4 4221 B11R1.28 CSCSCc1ccccn1 62a_100000721315_100011218213 [0,2,0,0,0,0|1,0,0]=3 4222 B11R1.28 CSCSCc1ccccn1 62a_100011218213_100000721315 [0,2,0,0,0,0|1,0,0]=3 4223 B11R1.28 CSCSCc1cccnc1 62a_100000741622_100011218213 [0,2,0,0,0,0|1,0,0]=3 4224 B11R1.28 CSCSCc1cccnc1 62a_100011218213_100000741622 [0,2,0,0,0,0|1,0,0]=3 4225 B11R1.28 CSCSCc1cccnn1 62a_100011218213_100016990269 [0,2,0,0,0,0|2,0,0]=4 4226 B11R1.28 CSCSCc1cccnn1 62a_100016990269_100011218213 [0,2,0,0,0,0|2,0,0]=4 4227 B11R1.28 CSCSCc1cnccn1 62a_100011218213_100016995436 [0,2,0,0,0,0|0,0,0]=2 4228 B11R1.28 CSCSCc1cnccn1 62a_100016995436_100011218213 [0,2,0,0,0,0|0,0,0]=2 4229 B11R1.28 CSCSCc1cncnc1 62a_100011218213_100015196519 [0,2,0,0,0,0|2,0,0]=4 4230 B11R1.28 CSCSCc1cncnc1 62a_100015196519_100011218213 [0,2,0,0,0,0|2,0,0]=4 4231 B11R1.28 CSCSCc1ncccn1 62a_100000703007_100011218213 [0,2,0,0,0,0|2,0,0]=4 4232 B11R1.28 CSCSCc1ncccn1 62a_100011218213_100000703007 [0,2,0,0,0,0|2,0,0]=4 4233 B11R1.28 FCCCNc1cnccn1 27a_100015189416_100000211759 [0,2,0,0,0,0|1,0,0]=3 4234 B11R1.28 FCCCOc1cccnc1 34a_100000210849_100011934791 [0,2,0,0,0,0|2,0,0]=4 4235 B11R1.28 FCCCOc1cccnc1 7a_100000210849_100011934791 [0,2,0,0,0,0|2,0,0]=4 4236 B11R1.28 FCCCSc1ccccn1 62a_100011216584_100011934791 [0,2,0,0,0,0|2,0,0]=4 4237 B11R1.28 FCCCSc1ccccn1 62a_100011934791_100011216584 [0,2,0,0,0,0|2,0,0]=4 4238 B11R1.28 FCCCSc1cccnc1 62a_100000210063_100011934791 [0,2,0,0,0,0|2,0,0]=4 4239 B11R1.28 FCCCSc1cccnc1 62a_100011934791_100000210063 [0,2,0,0,0,0|2,0,0]=4 4240 B11R1.28 FCCCSc1cnccn1 62a_100000211759_100011934791 [0,2,0,0,0,0|1,0,0]=3 4241 B11R1.28 FCCCSc1cnccn1 62a_100011934791_100000211759 [0,2,0,0,0,0|1,0,0]=3 4242 B11R1.28 FCCNCc1ccccn1 34a_100000724931_100000721315 [0,2,0,0,0,0|2,0,0]=4 4243 B11R1.28 FCCNCc1cccnc1 34a_100000724931_100000733263 [0,2,0,0,0,0|2,0,0]=4 4244 B11R1.28 FCCNCc1cnccn1 34a_100000724931_100016995436 [0,2,0,0,0,0|1,0,0]=3 4245 B11R1.28 FCCSCc1ccccn1 62a_100000721315_100011217306 [0,2,0,0,0,0|2,0,0]=4 4246 B11R1.28 FCCSCc1ccccn1 62a_100011217306_100000721315 [0,2,0,0,0,0|2,0,0]=4 4247 B11R1.28 FCCSCc1cccnc1 62a_100000741622_100011217306 [0,2,0,0,0,0|2,0,0]=4 4248 B11R1.28 FCCSCc1cccnc1 62a_100011217306_100000741622 [0,2,0,0,0,0|2,0,0]=4 4249 B11R1.28 FCCSCc1cnccn1 62a_100011217306_100016995436 [0,2,0,0,0,0|1,0,0]=3 4250 B11R1.28 FCCSCc1cnccn1 62a_100016995436_100011217306 [0,2,0,0,0,0|1,0,0]=3 4251 B11R1.28 FCOCCc1ccccn1 34a_100000210271_100015361967 [0,2,0,0,0,0|1,1,0]=4 4252 B11R1.28 FCOCCc1cccnc1 34a_100011217484_100015361967 [0,2,0,0,0,0|1,1,0]=4 4253 B11R1.28 FCOCCc1cnccn1 34a_100011349526_100015361967 [0,2,0,0,0,0|0,1,0]=3 4254 B11R1.28 FCSCCc1ccccc1 62a_100000765856_100015361967 [0,2,0,0,0,0|2,0,0]=4 4255 B11R1.28 FCSCCc1ccccc1 62a_100015361967_100011218657 [0,2,0,0,0,0|2,0,0]=4 4256 B11R1.28 FCSCCc1ccccn1 62a_100015183660_100015361967 [0,2,0,0,0,0|1,0,0]=3 4257 B11R1.28 FCSCCc1ccccn1 62a_100015361967_100015183660 [0,2,0,0,0,0|1,0,0]=3 4258 B11R1.28 FCSCCc1cccnc1 62a_100015361967_200011713674 [0,2,0,0,0,0|1,0,0]=3 4259 B11R1.28 FCSCCc1cccnc1 62a_200011713674_100015361967 [0,2,0,0,0,0|1,0,0]=3 4260 B11R1.28 N#CCCNc1cnccn1 27a_100000720768_100000211759 [0,2,0,0,0,0|1,0,0]=3 4261 B11R1.28 N#CCCOc1cccnc1 7a_100000210849_100000184422 [0,2,0,0,0,0|2,0,0]=4 4262 B11R1.28 N#CCCSc1ccccn1 62a_100011215226_100011216584 [0,2,0,0,0,0|2,0,0]=4 4263 B11R1.28 N#CCCSc1ccccn1 62a_100011216584_100011215226 [0,2,0,0,0,0|2,0,0]=4 4264 B11R1.28 N#CCCSc1cccnc1 62a_100000210063_100011215226 [0,2,0,0,0,0|2,0,0]=4 4265 B11R1.28 N#CCCSc1cccnc1 62a_100011215226_100000210063 [0,2,0,0,0,0|2,0,0]=4 4266 B11R1.28 N#CCCSc1cnccn1 62a_100000211759_100011215226 [0,2,0,0,0,0|1,0,0]=3 4267 B11R1.28 N#CCCSc1cnccn1 62a_100011215226_100000211759 [0,2,0,0,0,0|1,0,0]=3 4268 B11R1.28 N#CCSCc1ccccn1 62a_100000721315_100011215382 [0,2,0,0,0,0|2,0,0]=4 4269 B11R1.28 N#CCSCc1ccccn1 62a_100011215382_100000721315 [0,2,0,0,0,0|2,0,0]=4 4270 B11R1.28 N#CCSCc1cccnc1 62a_100000741622_100011215382 [0,2,0,0,0,0|2,0,0]=4 4271 B11R1.28 N#CCSCc1cccnc1 62a_100011215382_100000741622 [0,2,0,0,0,0|2,0,0]=4 4272 B11R1.28 N#CCSCc1cnccn1 62a_100011215382_100016995436 [0,2,0,0,0,0|1,0,0]=3 4273 B11R1.28 N#CCSCc1cnccn1 62a_100016995436_100011215382 [0,2,0,0,0,0|1,0,0]=3 4274 B11R1.28 N#CSCSc1ccccn1 62a_100000211825_100011216584 [0,2,0,0,0,0|2,0,0]=4 4275 B11R1.28 N#CSCSc1ccccn1 62a_100011216584_100000211825 [0,2,0,0,0,0|2,0,0]=4 4276 B11R1.28 N#CSCSc1cccnc1 62a_100000210063_100000211825 [0,2,0,0,0,0|2,0,0]=4 4277 B11R1.28 N#CSCSc1cccnc1 62a_100000211825_100000210063 [0,2,0,0,0,0|2,0,0]=4 4278 B11R1.28 N#CSCSc1cnccn1 62a_100000211759_100000211825 [0,2,0,0,0,0|1,0,0]=3 4279 B11R1.28 N#CSCSc1cnccn1 62a_100000211825_100000211759 [0,2,0,0,0,0|1,0,0]=3 4280 B11R1.28 NCCOCc1ccccn1 34a_100000210304_100000721315 [0,2,0,0,0,0|2,0,0]=4 4281 B11R1.28 NCCOCc1cccnc1 34a_100000210304_100000733263 [0,2,0,0,0,0|2,0,0]=4 4282 B11R1.28 NCCOCc1cnccn1 34a_100000210304_100016995436 [0,2,0,0,0,0|1,0,0]=3 4283 B11R1.28 O=CCSCc1ccccn1 62a_100000721315_200015260668 [0,2,0,0,0,0|1,1,0]=4 4284 B11R1.28 O=CCSCc1ccccn1 62a_200015260668_100000721315 [0,2,0,0,0,0|1,1,0]=4 4285 B11R1.28 O=CCSCc1cccnc1 62a_100000741622_200015260668 [0,2,0,0,0,0|1,1,0]=4 4286 B11R1.28 O=CCSCc1cccnc1 62a_200015260668_100000741622 [0,2,0,0,0,0|1,1,0]=4 4287 B11R1.28 O=CCSCc1cnccn1 62a_100016995436_200015260668 [0,2,0,0,0,0|0,1,0]=3 4288 B11R1.28 O=CCSCc1cnccn1 62a_200015260668_100016995436 [0,2,0,0,0,0|0,1,0]=3 4289 B11R1.28 OCCCNc1cnccn1 27a_100000182051_100000211759 [0,2,0,0,0,0|0,1,0]=3 4290 B11R1.28 OCCCOc1cccnc1 34a_100000210849_100000230001 [0,2,0,0,0,0|1,1,0]=4 4291 B11R1.28 OCCCOc1cccnc1 7a_100000210849_100011215043 [0,2,0,0,0,0|1,1,0]=4 4292 B11R1.28 OCCCSc1ccccn1 62a_100011215043_100011216584 [0,2,0,0,0,0|1,1,0]=4 4293 B11R1.28 OCCCSc1ccccn1 62a_100011216584_100011215043 [0,2,0,0,0,0|1,1,0]=4 4294 B11R1.28 OCCCSc1cccnc1 62a_100000210063_100011215043 [0,2,0,0,0,0|1,1,0]=4 4295 B11R1.28 OCCCSc1cccnc1 62a_100011215043_100000210063 [0,2,0,0,0,0|1,1,0]=4 4296 B11R1.28 OCCCSc1cnccn1 62a_100000211759_100011215043 [0,2,0,0,0,0|0,1,0]=3 4297 B11R1.28 OCCCSc1cnccn1 62a_100011215043_100000211759 [0,2,0,0,0,0|0,1,0]=3 4298 B11R1.28 OCCNCc1ccccn1 207a_100000210304_100000209966 [0,2,0,0,0,0|1,1,0]=4 4299 B11R1.28 OCCNCc1ccccn1 2230a_100016997473_100000721315 [0,2,0,0,0,0|1,1,0]=4 4300 B11R1.28 OCCNCc1ccccn1 270004a_100000210304_100000209966 [0,2,0,0,0,0|1,1,0]=4 4301 B11R1.28 OCCNCc1ccccn1 34a_100016990907_100000721315 [0,2,0,0,0,0|1,1,0]=4 4302 B11R1.28 OCCNCc1cccnc1 207a_100000210304_100000209961 [0,2,0,0,0,0|1,1,0]=4 4303 B11R1.28 OCCNCc1cccnc1 2230a_100016997473_100000741622 [0,2,0,0,0,0|1,1,0]=4 4304 B11R1.28 OCCNCc1cccnc1 270004a_100000210304_100000209961 [0,2,0,0,0,0|1,1,0]=4 4305 B11R1.28 OCCNCc1cccnc1 34a_100016990907_100000733263 [0,2,0,0,0,0|1,1,0]=4 4306 B11R1.28 OCCNCc1cnccn1 2230a_100016997473_100016995436 [0,2,0,0,0,0|0,1,0]=3 4307 B11R1.28 OCCNCc1cnccn1 270004a_100000210304_100000749867 [0,2,0,0,0,0|0,1,0]=3 4308 B11R1.28 OCCNCc1cnccn1 34a_100016990907_100016995436 [0,2,0,0,0,0|0,1,0]=3 4309 B11R1.28 OCCSCc1ccccn1 62a_100000211926_100000721315 [0,2,0,0,0,0|1,1,0]=4 4310 B11R1.28 OCCSCc1ccccn1 62a_100000721315_100000211926 [0,2,0,0,0,0|1,1,0]=4 4311 B11R1.28 OCCSCc1cccnc1 62a_100000211926_100000741622 [0,2,0,0,0,0|1,1,0]=4 4312 B11R1.28 OCCSCc1cccnc1 62a_100000741622_100000211926 [0,2,0,0,0,0|1,1,0]=4 4313 B11R1.28 OCCSCc1cnccn1 62a_100000211926_100016995436 [0,2,0,0,0,0|0,1,0]=3 4314 B11R1.28 OCCSCc1cnccn1 62a_100016995436_100000211926 [0,2,0,0,0,0|0,1,0]=3 4315 B11R1.28 [13CH3]NCCCc1cccnc1 2230a_100011532358_200025704644 [0,2,0,0,0,0|2,0,0]=4 4316 B11R1.28 [13CH3]NCCCc1cccnc1 34a_100011532358_200025704644 [0,2,0,0,0,0|2,0,0]=4 4317 B11R1.28 [13CH3]NCCOc1ccccn1 2230a_106741647558_200025704644 [0,2,0,0,0,0|2,0,0]=4 4318 B11R1.28 [13CH3]NCCOc1cccnc1 2230a_100000754688_200025704644 [0,2,0,0,0,0|2,0,0]=4 4319 B11R1.28 [13CH3]OCCCc1ccccn1 34a_100011215068_200025704644 [0,2,0,0,0,0|1,1,0]=4 4320 B11R1.28 [13CH3]OCCCc1cccnc1 34a_100000211284_200025704644 [0,2,0,0,0,0|1,1,0]=4 4321 B11R1.28 [13CH3]OCCSc1ccccn1 7a_100000156319_200025704644 [0,2,0,0,0,0|1,1,0]=4 4322 B11R1.28 [13CH3]SCCCc1ccccc1 62a_100000211621_200025704644 [0,2,0,0,0,0|2,0,0]=4 4323 B11R1.28 [13CH3]SCCCc1ccccc1 62a_200025704644_100000211621 [0,2,0,0,0,0|2,0,0]=4 4324 B11R1.28 [13CH3]SCCOc1ccccc1 62a_100000184471_200025704644 [0,2,0,0,0,0|2,0,0]=4 4325 B11R1.28 [13CH3]SCCOc1ccccc1 62a_200025704644_100000184471 [0,2,0,0,0,0|2,0,0]=4 4326 B11R1.28 [13CH3]SCCSc1ccccc1 62a_100000246102_200025704644 [0,2,0,0,0,0|2,0,0]=4 4327 B11R1.28 [13CH3]SCCSc1ccccc1 62a_200025704644_100000246102 [0,2,0,0,0,0|2,0,0]=4 4328 B11R1.28 [13CH3]SCOCc1ccccc1 62a_100000763385_200025704644 [0,2,0,0,0,0|2,0,0]=4 4329 B11R1.28 [13CH3]SCOCc1ccccc1 62a_200025704644_100000763385 [0,2,0,0,0,0|2,0,0]=4 4330 B11R1.28 [13CH3]SCSCc1ccccc1 62a_200011217039_200025704644 [0,2,0,0,0,0|2,0,0]=4 4331 B11R1.28 [13CH3]SCSCc1ccccc1 62a_200025704644_200011217039 [0,2,0,0,0,0|2,0,0]=4 4332 B11R1.40 C#CC(=O)Cc1cnccn1 1458a_100000211873_100016995436 [0,2,0,0,0,0|0,1,1]=4 4333 B11R1.40 C#CC(C)Nc1cnccn1 27a_100000707721_100000211759 [0,2,0,0,0,0|1,0,1]=4 4334 B11R1.40 C#CC(C)Sc1cnccn1 62a_200000035995_100000211759 [0,2,0,0,0,0|1,0,1]=4 4335 B11R1.40 C=CC(=O)Cc1cnccn1 1458a_100000185746_100016995436 [0,2,0,0,0,0|0,1,1]=4 4336 B11R1.40 C=CC(C)Sc1cnccn1 62a_100011215867_100000211759 [0,2,0,0,0,0|1,0,1]=4 4337 B11R1.40 CC(C#N)Sc1cnccn1 62a_100000211759_100000703298 [0,2,0,0,0,0|1,0,1]=4 4338 B11R1.40 CC(C#N)Sc1cnccn1 62a_100000703298_100000211759 [0,2,0,0,0,0|1,0,1]=4 4339 B11R1.40 CC(CO)Oc1cccnc1 34a_100000210849_100012180447 [0,2,0,0,0,0|1,1,0]=4 4340 B11R1.40 CC(CO)Oc1cccnc1 7a_100000210849_100012180447 [0,2,0,0,0,0|1,1,0]=4 4341 B11R1.40 CC(CO)Sc1ccccn1 62a_100012180447_100011216584 [0,2,0,0,0,0|1,1,0]=4 4342 B11R1.40 CC(CO)Sc1cccnc1 62a_100012180447_100000210063 [0,2,0,0,0,0|1,1,0]=4 4343 B11R1.40 CC(CO)Sc1cnccn1 62a_100012180447_100000211759 [0,2,0,0,0,0|0,1,0]=3 4344 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200011218536_200025704644 [0,2,0,0,0,0|2,0,0]=4 4345 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200025704644_200011218536 [0,2,0,0,0,0|2,0,0]=4 4346 B11R1.40 CC(Cc1ccccn1)N[13CH3] 2230a_100000238496_200025704644 [0,2,0,0,0,0|2,0,0]=4 4347 B11R1.40 CC(Cc1cccnc1)N[13CH3] 2230a_100011207255_200025704644 [0,2,0,0,0,0|2,0,0]=4 4348 B11R1.40 CC(Cc1cnccn1)N[13CH3] 2230a_100011277835_200025704644 [0,2,0,0,0,0|1,0,0]=3 4349 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000210414_100000721315 [0,2,0,0,0,0|2,0,0]=4 4350 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000233486_100000210202 [0,2,0,0,0,0|2,0,0]=4 4351 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000210414_100000733263 [0,2,0,0,0,0|2,0,0]=4 4352 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000737805_100000210202 [0,2,0,0,0,0|2,0,0]=4 4353 B11R1.40 CCC(=O)Cc1cnccn1 1458a_100000210414_100016995436 [0,2,0,0,0,0|1,0,0]=3 4354 B11R1.40 CCC(C)Oc1cccnc1 34a_100000210849_100011215416 [0,2,0,0,0,0|2,0,0]=4 4355 B11R1.40 CCC(C)Oc1cccnc1 7a_100000210849_100000758301 [0,2,0,0,0,0|2,0,0]=4 4356 B11R1.40 CCC(C)Sc1ccccn1 62a_100000758301_100011216584 [0,2,0,0,0,0|2,0,0]=4 4357 B11R1.40 CCC(C)Sc1ccccn1 62a_100011216584_100000758301 [0,2,0,0,0,0|2,0,0]=4 4358 B11R1.40 CCC(C)Sc1cccnc1 62a_100000210063_100000758301 [0,2,0,0,0,0|2,0,0]=4 4359 B11R1.40 CCC(C)Sc1cccnc1 62a_100000758301_100000210063 [0,2,0,0,0,0|2,0,0]=4 4360 B11R1.40 CCC(C)Sc1cnccn1 62a_100000211759_100000758301 [0,2,0,0,0,0|1,0,0]=3 4361 B11R1.40 CCC(C)Sc1cnccn1 62a_100000758301_100000211759 [0,2,0,0,0,0|1,0,0]=3 4362 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000201164_200000210301 [0,2,0,0,0,0|2,0,0]=4 4363 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000207498_100000210202 [0,2,0,0,0,0|2,0,0]=4 4364 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000225621_100000721315 [0,2,0,0,0,0|2,0,0]=4 4365 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000201164_200000210301 [0,2,0,0,0,0|2,0,0]=4 4366 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000207498_100000204670 [0,2,0,0,0,0|2,0,0]=4 4367 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000225621_100000721315 [0,2,0,0,0,0|2,0,0]=4 4368 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000184577_100000210202 [0,2,0,0,0,0|2,0,0]=4 4369 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000186920_200000210301 [0,2,0,0,0,0|2,0,0]=4 4370 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000225621_100000741622 [0,2,0,0,0,0|2,0,0]=4 4371 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000184577_100000204670 [0,2,0,0,0,0|2,0,0]=4 4372 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000186920_200000210301 [0,2,0,0,0,0|2,0,0]=4 4373 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000225621_100000733263 [0,2,0,0,0,0|2,0,0]=4 4374 B11R1.40 CCN(C)Cc1cnccn1 2230a_100000225621_100016995436 [0,2,0,0,0,0|1,0,0]=3 4375 B11R1.40 CCN(C)Cc1cnccn1 2230a_100011269079_100000210202 [0,2,0,0,0,0|1,0,0]=3 4376 B11R1.40 CCN(C)Cc1cnccn1 269982a_100000225621_100016995436 [0,2,0,0,0,0|1,0,0]=3 4377 B11R1.40 CCN(C)Cc1cnccn1 269982a_100011269079_100000204670 [0,2,0,0,0,0|1,0,0]=3 4378 B11R1.40 CCN([13CH3])Cc1ccccn1 2230a_100000201164_200025704644 [0,2,0,0,0,0|2,0,0]=4 4379 B11R1.40 CCN([13CH3])Cc1ccccn1 269982a_100000201164_200025704644 [0,2,0,0,0,0|2,0,0]=4 4380 B11R1.40 CCN([13CH3])Cc1cccnc1 2230a_100000186920_200025704644 [0,2,0,0,0,0|2,0,0]=4 4381 B11R1.40 CCN([13CH3])Cc1cccnc1 269982a_100000186920_200025704644 [0,2,0,0,0,0|2,0,0]=4 4382 B11R1.40 CN(CF)Cc1ccccn1 269982a_100000207498_100015361967 [0,2,0,0,0,0|2,0,0]=4 4383 B11R1.40 CN(CF)Cc1cccnc1 269982a_100000184577_100015361967 [0,2,0,0,0,0|2,0,0]=4 4384 B11R1.40 CN(CF)Cc1cnccn1 269982a_100011269079_100015361967 [0,2,0,0,0,0|1,0,0]=3 4385 B11R1.40 CNC(=O)Cc1cnccn1 11a_106832991635_100000726051 [0,2,0,0,0,0|0,1,1]=4 4386 B11R1.40 CNC(=O)Cc1cnccn1 240690a_100102657272_100000726051 [0,2,0,0,0,0|0,1,1]=4 4387 B11R1.40 CNC(=O)Cc1cnccn1 527a_100102657272_100000726051 [0,2,0,0,0,0|0,1,1]=4 4388 B11R1.40 CNC(C)Cc1ccccn1 2230a_100000238496_200000210301 [0,2,0,0,0,0|2,0,0]=4 4389 B11R1.40 CNC(C)Cc1cccnc1 2230a_100011207255_200000210301 [0,2,0,0,0,0|2,0,0]=4 4390 B11R1.40 CNC(C)Cc1cccnc1 270004a_106832991635_100015187140 [0,2,0,0,0,0|2,0,0]=4 4391 B11R1.40 CNC(C)Cc1cnccn1 2230a_100011277835_200000210301 [0,2,0,0,0,0|1,0,0]=3 4392 B11R1.40 CNC(C)Cc1cnccn1 270004a_106832991635_100015184882 [0,2,0,0,0,0|1,0,0]=3 4393 B11R1.40 COC(C)Sc1cnccn1 62a_100000211759_100009879195 [0,2,0,0,0,0|1,1,0]=4 4394 B11R1.40 COC(C)Sc1cnccn1 62a_100009879195_100000211759 [0,2,0,0,0,0|1,1,0]=4 4395 B11R1.40 CSC(C)Cc1ccccc1 62a_200000210301_200011218536 [0,2,0,0,0,0|2,0,0]=4 4396 B11R1.40 CSC(C)Cc1ccccc1 62a_200011218536_200000210301 [0,2,0,0,0,0|2,0,0]=4 4397 B11R1.40 C[C@H](CF)Nc1cnccn1 27a_100102880703_100000211759 [0,2,0,0,0,0|1,0,0]=3 4398 B11R1.40 C[C@H](CO)Nc1cnccn1 27a_100000737577_100000211759 [0,2,0,0,0,0|0,1,0]=3 4399 B11R1.40 C[C@H](CO)Sc1ccccn1 62a_100011216584_100016084084 [0,2,0,0,0,0|1,1,0]=4 4400 B11R1.40 C[C@H](CO)Sc1ccccn1 62a_100016084084_100011216584 [0,2,0,0,0,0|1,1,0]=4 4401 B11R1.40 C[C@H](CO)Sc1cccnc1 62a_100000210063_100016084084 [0,2,0,0,0,0|1,1,0]=4 4402 B11R1.40 C[C@H](CO)Sc1cccnc1 62a_100016084084_100000210063 [0,2,0,0,0,0|1,1,0]=4 4403 B11R1.40 C[C@H](CO)Sc1cnccn1 62a_100000211759_100016084084 [0,2,0,0,0,0|0,1,0]=3 4404 B11R1.40 C[C@H](CO)Sc1cnccn1 62a_100016084084_100000211759 [0,2,0,0,0,0|0,1,0]=3 4405 B11R1.40 N#CC(F)Sc1cnccn1 62a_100000211759_200000117898 [0,2,0,0,0,0|1,0,1]=4 4406 B11R1.40 N#CC(F)Sc1cnccn1 62a_200000117898_100000211759 [0,2,0,0,0,0|1,0,1]=4 4407 B11R1.40 O=C(CF)Cc1ccccn1 1458a_100000233486_100015361967 [0,2,0,0,0,0|2,0,0]=4 4408 B11R1.40 O=C(CF)Cc1cccnc1 1458a_100000737805_100015361967 [0,2,0,0,0,0|2,0,0]=4 4409 B11R1.40 O=C(CO)Cc1ccccn1 1458a_100000210174_100000721315 [0,2,0,0,0,0|1,1,0]=4 4410 B11R1.40 O=C(CO)Cc1cccnc1 1458a_100000210174_100000733263 [0,2,0,0,0,0|1,1,0]=4 4411 B11R1.40 O=C(CO)Cc1cnccn1 1458a_100000210174_100016995436 [0,2,0,0,0,0|0,1,0]=3 4412 B11R1.91 C=C(C)CNc1cnccn1 27a_100000765925_100000211759 [0,2,0,0,0,0|1,0,1]=4 4413 B11R1.91 C=C(C)CSc1cnccn1 62a_100000211759_100000211660 [0,2,0,0,0,0|1,0,1]=4 4414 B11R1.91 C=C(C)CSc1cnccn1 62a_100000748629_100000211759 [0,2,0,0,0,0|1,0,1]=4 4415 B11R1.91 C=C(F)CSc1cnccn1 62a_100000042424_100000211759 [0,2,0,0,0,0|1,0,1]=4 4416 B11R1.91 C=C(F)CSc1cnccn1 62a_100000211759_100000042424 [0,2,0,0,0,0|1,0,1]=4 4417 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [0,2,0,0,0,0|1,1,0]=4 4418 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [0,2,0,0,0,0|1,1,0]=4 4419 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [0,2,0,0,0,0|1,1,0]=4 4420 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [0,2,0,0,0,0|1,1,0]=4 4421 B11R1.91 CC(=O)NCc1cnccn1 11a_100000737960_100015343762 [0,2,0,0,0,0|0,1,1]=4 4422 B11R1.91 CC(=O)NCc1cnccn1 240690a_100000737960_100015343762 [0,2,0,0,0,0|0,1,1]=4 4423 B11R1.91 CC(=O)NCc1cnccn1 527a_100000737960_100103153847 [0,2,0,0,0,0|0,1,1]=4 4424 B11R1.91 CC(C)C=Cc1cnccn1 271570a_100016257149_100000758340 [0,2,0,0,0,0|1,0,1]=4 4425 B11R1.91 CC(C)CNc1cnccn1 27a_100000210953_100000211759 [0,2,0,0,0,0|1,0,0]=3 4426 B11R1.91 CC(C)COc1cccnc1 34a_100000210849_100000210624 [0,2,0,0,0,0|2,0,0]=4 4427 B11R1.91 CC(C)COc1cccnc1 7a_100000210849_100000210760 [0,2,0,0,0,0|2,0,0]=4 4428 B11R1.91 CC(C)CSc1ccccn1 62a_100000210624_100011216584 [0,2,0,0,0,0|2,0,0]=4 4429 B11R1.91 CC(C)CSc1ccccn1 62a_100011216584_100000210760 [0,2,0,0,0,0|2,0,0]=4 4430 B11R1.91 CC(C)CSc1cccnc1 62a_100000210063_100000210760 [0,2,0,0,0,0|2,0,0]=4 4431 B11R1.91 CC(C)CSc1cccnc1 62a_100000210624_100000210063 [0,2,0,0,0,0|2,0,0]=4 4432 B11R1.91 CC(C)CSc1cnccn1 62a_100000210624_100000211759 [0,2,0,0,0,0|1,0,0]=3 4433 B11R1.91 CC(C)CSc1cnccn1 62a_100000211759_100000210760 [0,2,0,0,0,0|1,0,0]=3 4434 B11R1.91 CC(C)NCc1ccccn1 207a_100138425928_100000209966 [0,2,0,0,0,0|2,0,0]=4 4435 B11R1.91 CC(C)NCc1ccccn1 2230a_100138425928_100000721315 [0,2,0,0,0,0|2,0,0]=4 4436 B11R1.91 CC(C)NCc1ccccn1 34a_100138425928_100000721315 [0,2,0,0,0,0|2,0,0]=4 4437 B11R1.91 CC(C)NCc1cccnc1 207a_100138425928_100000209961 [0,2,0,0,0,0|2,0,0]=4 4438 B11R1.91 CC(C)NCc1cccnc1 2230a_100138425928_100000741622 [0,2,0,0,0,0|2,0,0]=4 4439 B11R1.91 CC(C)NCc1cccnc1 34a_100138425928_100000733263 [0,2,0,0,0,0|2,0,0]=4 4440 B11R1.91 CC(C)NCc1cnccn1 2230a_100138425928_100016995436 [0,2,0,0,0,0|1,0,0]=3 4441 B11R1.91 CC(C)NCc1cnccn1 34a_100138425928_100016995436 [0,2,0,0,0,0|1,0,0]=3 4442 B11R1.91 CC(C)OCc1ccccn1 34a_100000212225_100000721315 [0,2,0,0,0,0|2,0,0]=4 4443 B11R1.91 CC(C)OCc1cccnc1 34a_100000212225_100000733263 [0,2,0,0,0,0|2,0,0]=4 4444 B11R1.91 CC(C)OCc1cnccn1 34a_100000212225_100016995436 [0,2,0,0,0,0|1,0,0]=3 4445 B11R1.91 CC(C)SCc1ccccn1 62a_100000210206_100000721315 [0,2,0,0,0,0|2,0,0]=4 4446 B11R1.91 CC(C)SCc1ccccn1 62a_100000721315_100000210206 [0,2,0,0,0,0|2,0,0]=4 4447 B11R1.91 CC(C)SCc1cccnc1 62a_100000210206_100000741622 [0,2,0,0,0,0|2,0,0]=4 4448 B11R1.91 CC(C)SCc1cccnc1 62a_100000741622_100000210206 [0,2,0,0,0,0|2,0,0]=4 4449 B11R1.91 CC(C)SCc1cnccn1 62a_100000210206_100016995436 [0,2,0,0,0,0|1,0,0]=3 4450 B11R1.91 CC(C)SCc1cnccn1 62a_100016995436_100000210206 [0,2,0,0,0,0|1,0,0]=3 4451 B11R1.91 CC(O)C=Cc1cnccn1 271570a_200011019289_100000758340 [0,2,0,0,0,0|0,1,1]=4 4452 B11R1.91 CC(O)CNc1cnccn1 27a_100000210904_100000211759 [0,2,0,0,0,0|0,1,0]=3 4453 B11R1.91 CC(O)COc1cccnc1 34a_100000210849_100011218427 [0,2,0,0,0,0|1,1,0]=4 4454 B11R1.91 CC(O)COc1cccnc1 7a_100000210849_100011218427 [0,2,0,0,0,0|1,1,0]=4 4455 B11R1.91 CC(O)CSc1ccccn1 62a_100011216584_100011218427 [0,2,0,0,0,0|1,1,0]=4 4456 B11R1.91 CC(O)CSc1ccccn1 62a_100011218427_100011216584 [0,2,0,0,0,0|1,1,0]=4 4457 B11R1.91 CC(O)CSc1cccnc1 62a_100000210063_100011218427 [0,2,0,0,0,0|1,1,0]=4 4458 B11R1.91 CC(O)CSc1cccnc1 62a_100011218427_100000210063 [0,2,0,0,0,0|1,1,0]=4 4459 B11R1.91 CC(O)CSc1cnccn1 62a_100000211759_100011218427 [0,2,0,0,0,0|0,1,0]=3 4460 B11R1.91 CC(O)CSc1cnccn1 62a_100011218427_100000211759 [0,2,0,0,0,0|0,1,0]=3 4461 B11R1.91 CN(C)CCc1ccccn1 2230a_100000737206_200000210301 [0,2,0,0,0,0|2,0,0]=4 4462 B11R1.91 CN(C)CCc1ccccn1 2230a_100102631434_100015183660 [0,2,0,0,0,0|2,0,0]=4 4463 B11R1.91 CN(C)CCc1ccccn1 269982a_100000737206_200000210301 [0,2,0,0,0,0|2,0,0]=4 4464 B11R1.91 CN(C)CCc1ccccn1 269982a_100102631434_100015183660 [0,2,0,0,0,0|2,0,0]=4 4465 B11R1.91 CN(C)CCc1cccnc1 2230a_100000763209_200000210301 [0,2,0,0,0,0|2,0,0]=4 4466 B11R1.91 CN(C)CCc1cccnc1 2230a_100102631434_200011713674 [0,2,0,0,0,0|2,0,0]=4 4467 B11R1.91 CN(C)CCc1cccnc1 269982a_100000763209_200000210301 [0,2,0,0,0,0|2,0,0]=4 4468 B11R1.91 CN(C)CCc1cccnc1 269982a_100102631434_200011713674 [0,2,0,0,0,0|2,0,0]=4 4469 B11R1.91 CN([13CH3])CCc1ccccn1 2230a_100000737206_200025704644 [0,2,0,0,0,0|2,0,0]=4 4470 B11R1.91 CN([13CH3])CCc1ccccn1 269982a_100000737206_200025704644 [0,2,0,0,0,0|2,0,0]=4 4471 B11R1.91 CN([13CH3])CCc1cccnc1 2230a_100000763209_200025704644 [0,2,0,0,0,0|2,0,0]=4 4472 B11R1.91 CN([13CH3])CCc1cccnc1 269982a_100000763209_200025704644 [0,2,0,0,0,0|2,0,0]=4 4473 B11R1.91 C[C@@H](O)COc1cccnc1 34a_100000210849_100009817552 [0,2,0,0,0,0|1,1,0]=4 4474 B11R1.91 C[C@@H](O)COc1cccnc1 7a_100000210849_100009817552 [0,2,0,0,0,0|1,1,0]=4 4475 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100009817552_100011216584 [0,2,0,0,0,0|1,1,0]=4 4476 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100011216584_100009817552 [0,2,0,0,0,0|1,1,0]=4 4477 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100000210063_100009817552 [0,2,0,0,0,0|1,1,0]=4 4478 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100009817552_100000210063 [0,2,0,0,0,0|1,1,0]=4 4479 B11R1.91 C[C@@H](O)CSc1cnccn1 62a_100000211759_100009817552 [0,2,0,0,0,0|0,1,0]=3 4480 B11R1.91 C[C@@H](O)CSc1cnccn1 62a_100009817552_100000211759 [0,2,0,0,0,0|0,1,0]=3 4481 B11R1.91 FC(F)CNc1cnccn1 27a_100000765723_100000211759 [0,2,0,0,0,0|1,0,0]=3 4482 B11R1.91 FC(F)COc1cccnc1 34a_100000210849_100011934356 [0,2,0,0,0,0|2,0,0]=4 4483 B11R1.91 FC(F)COc1cccnc1 7a_100000210849_100011934356 [0,2,0,0,0,0|2,0,0]=4 4484 B11R1.91 FC(F)CSc1ccccn1 62a_100011216584_100011934356 [0,2,0,0,0,0|2,0,0]=4 4485 B11R1.91 FC(F)CSc1ccccn1 62a_100011934356_100011216584 [0,2,0,0,0,0|2,0,0]=4 4486 B11R1.91 FC(F)CSc1cccnc1 62a_100000210063_100011934356 [0,2,0,0,0,0|2,0,0]=4 4487 B11R1.91 FC(F)CSc1cccnc1 62a_100011934356_100000210063 [0,2,0,0,0,0|2,0,0]=4 4488 B11R1.91 FC(F)CSc1cnccn1 62a_100000211759_100011934356 [0,2,0,0,0,0|1,0,0]=3 4489 B11R1.91 FC(F)CSc1cnccn1 62a_100011934356_100000211759 [0,2,0,0,0,0|1,0,0]=3 4490 B11R1.91 NC(=O)CSc1cnccn1 62a_100000211759_100000747473 [0,2,0,0,0,0|0,1,1]=4 4491 B11R1.91 NC(=O)CSc1cnccn1 62a_100000747473_100000211759 [0,2,0,0,0,0|0,1,1]=4 4492 B11R1.91 O=C([O-])CSc1cnccn1 62a_100000211759_100020667443 [0,2,0,0,0,0|0,1,1]=4 4493 B11R1.91 O=C([O-])CSc1cnccn1 62a_100020667443_100000211759 [0,2,0,0,0,0|0,1,1]=4 4494 B11R1.91 O=[N+]([O-])CSc1cnccn1 62a_100000211759_100000761209 [0,2,0,0,0,0|1,1,0]=4 4495 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [0,2,0,0,0,0|1,1,0]=4 4496 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [0,2,0,0,0,0|1,1,0]=4 4497 B11R1.509 CC(C)(C)Sc1cnccn1 62a_100000211759_100000211941 [0,2,0,0,0,0|2,0,0]=4 4498 B11R1.509 CC(C)(C)Sc1cnccn1 62a_100000211941_100000211759 [0,2,0,0,0,0|2,0,0]=4 4499 B11R1.509 FC(F)(F)Sc1cnccn1 62a_100000211759_200103152311 [0,2,0,0,0,0|2,0,0]=4 4500 B11R1.509 FC(F)(F)Sc1cnccn1 62a_200000243211_100000211759 [0,2,0,0,0,0|2,0,0]=4 4501 B9R2.2 c1c[nH]c(n1)C2CC2 271570a_100011220607_100025796157 [0,0,0,1,1,0|1,0,1]=4 4502 B9R2.2 c1cc(co1)C2CC2 271570a_100011220607_100011215275 [0,0,0,1,1,0|2,0,0]=4 4503 B9R2.2 c1cc(cs1)C2CC2 271570a_100011220607_100000738268 [0,0,0,1,1,0|2,0,0]=4 4504 B9R2.2 c1cc(n[nH]1)C2CC2 271570a_100011220607_100000062575 [0,0,0,1,1,0|2,0,0]=4 4505 B9R2.2 c1cc(ns1)C2CC2 271570a_100011220607_100009818082 [0,0,0,1,1,0|2,0,0]=4 4506 B9R2.2 c1coc(c1)C2CC2 271570a_100011220607_100009814098 [0,0,0,1,1,0|2,0,0]=4 4507 B9R2.2 c1coc(n1)C2CC2 271570a_100011220607_100011787736 [0,0,0,1,1,0|2,0,0]=4 4508 B9R2.2 c1csc(c1)C2CC2 271570a_100011220607_100011215356 [0,0,0,1,1,0|2,0,0]=4 4509 B9R2.2 c1csc(n1)C2CC2 271570a_100011220607_100000211983 [0,0,0,1,1,0|2,0,0]=4 4510 B9R2.2 c1n[nH]cc1C2CC2 271570a_100011220607_100000238712 [0,0,0,1,1,0|2,0,0]=4 4511 B9R2.2 c1nc(c[nH]1)C2CC2 271570a_100011220607_100000756875 [0,0,0,1,1,0|1,0,1]=4 4512 B9R2.2 c1nc(cs1)C2CC2 271570a_100011220607_100000751502 [0,0,0,1,1,0|2,0,0]=4 4513 B9R2.2 c1nc(n[nH]1)C2CC2 271570a_100011220607_100000761765 [0,0,0,1,1,0|2,0,0]=4 4514 B9R2.2 c1ncc(o1)C2CC2 271570a_100011220607_100020591547 [0,0,0,1,1,0|2,0,0]=4 4515 B9R2.2 c1ncc(s1)C2CC2 271570a_100011220607_100011934649 [0,0,0,1,1,0|2,0,0]=4 4516 B9R2.2 c1nocc1C2CC2 271570a_100011220607_100009815712 [0,0,0,1,1,0|2,0,0]=4 4517 B9R2.2 c1nsc(n1)C2CC2 271570a_100011220607_100000693119 [0,0,0,1,1,0|2,0,0]=4 4518 B9R2.2 c1nscc1C2CC2 271570a_100011220607_100009815736 [0,0,0,1,1,0|2,0,0]=4 4519 B11R2.34 Brc1ccc(cn1)C2CC2 271570a_100011220607_100009814638 [0,1,0,1,0,0|2,0,0]=4 4520 B11R2.34 Brc1ccc(nc1)C2CC2 271570a_100011220607_100000686858 [0,1,0,1,0,0|2,0,0]=4 4521 B11R2.34 Cc1ccc(cn1)C2CC2 271570a_100011220607_100000751577 [0,1,0,1,0,0|2,0,0]=4 4522 B11R2.34 Cc1ccc(nc1)C2CC2 271570a_100011220607_100000754016 [0,1,0,1,0,0|2,0,0]=4 4523 B11R2.34 Cc1cnc(cn1)C2CC2 271570a_100011220607_100011999403 [0,1,0,1,0,0|1,0,0]=3 4524 B11R2.34 Clc1ccc(cn1)C2CC2 271570a_100011220607_100000034144 [0,1,0,1,0,0|2,0,0]=4 4525 B11R2.34 Clc1ccc(nc1)C2CC2 271570a_100011220607_100011356976 [0,1,0,1,0,0|2,0,0]=4 4526 B11R2.34 Fc1ccc(cn1)C2CC2 271570a_100011220607_100000748661 [0,1,0,1,0,0|2,0,0]=4 4527 B11R2.34 Fc1ccc(nc1)C2CC2 271570a_100011220607_100000744514 [0,1,0,1,0,0|2,0,0]=4 4528 B11R2.34 Fc1cnc(cn1)C2CC2 271570a_100011220607_100009856528 [0,1,0,1,0,0|1,0,0]=3 4529 B11R2.34 Nc1ccc(cn1)C2CC2 271570a_100011220607_100000187370 [0,1,0,1,0,0|2,0,0]=4 4530 B11R2.34 Nc1ccc(nc1)C2CC2 271570a_100011220607_100000744251 [0,1,0,1,0,0|2,0,0]=4 4531 B11R2.34 Nc1cnc(cn1)C2CC2 271570a_100011220607_100000761932 [0,1,0,1,0,0|1,0,0]=3 4532 B11R2.34 Nc1ncc(nn1)C2CC2 271570a_100011220607_100000691435 [0,1,0,1,0,0|2,0,0]=4 4533 B11R2.34 Oc1ccc(cn1)C2CC2 271570a_203496583355_200000118129 [0,1,0,1,0,0|2,0,0]=4 4534 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_100011220607_100000685995 [0,1,0,1,0,0|2,0,0]=4 4535 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_203496583355_100009850895 [0,1,0,1,0,0|2,0,0]=4 4536 B11R2.34 Oc1cnc(cn1)C2CC2 271570a_203496583355_100012002519 [0,1,0,1,0,0|1,0,0]=3 4537 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [0,1,0,1,0,0|2,0,0]=4 4538 B11R2.36 Oc1ccc2c(n1)CCC2 271570a_203496583355_100000046531 [0,1,0,1,0,0|2,0,0]=4 4539 B11R2.36 Oc1ccc2c(n1)CCN2 271570a_203496583355_100009872833 [0,1,0,1,0,0|2,0,0]=4 4540 B11R2.36 Oc1cnc2c(c1)CCC2 271570a_203496583355_100000693888 [0,1,0,1,0,0|2,0,0]=4 4541 B11R2.36 Oc1cnc2c(c1)CCN2 271570a_203496583355_100009817725 [0,1,0,1,0,0|2,0,0]=4 4542 B11R2.36 Oc1cnc2c(c1)NCC2 271570a_203496583355_100000698607 [0,1,0,1,0,0|2,0,0]=4 4543 B11R2.55 Brc1cccnc1C2CC2 271570a_100011220607_100000696092 [0,1,0,1,0,0|2,0,0]=4 4544 B11R2.55 Brc1ccncc1C2CC2 271570a_100011220607_100010138639 [0,1,0,1,0,0|2,0,0]=4 4545 B11R2.55 Brc1ncccc1C2CC2 271570a_100011220607_100010202626 [0,1,0,1,0,0|2,0,0]=4 4546 B11R2.55 Cc1cccnc1C2CC2 271570a_100011220607_100000751373 [0,1,0,1,0,0|2,0,0]=4 4547 B11R2.55 Cc1ccncc1C2CC2 271570a_100011220607_100000761580 [0,1,0,1,0,0|2,0,0]=4 4548 B11R2.55 Cc1ncccc1C2CC2 271570a_100011220607_100000751574 [0,1,0,1,0,0|2,0,0]=4 4549 B11R2.55 Cc1nccnc1C2CC2 271570a_100011220607_100011999405 [0,1,0,1,0,0|1,0,0]=3 4550 B11R2.55 Clc1cccnc1C2CC2 271570a_100011220607_100011356963 [0,1,0,1,0,0|2,0,0]=4 4551 B11R2.55 Clc1ccncc1C2CC2 271570a_100011220607_100009995489 [0,1,0,1,0,0|2,0,0]=4 4552 B11R2.55 Clc1ncccc1C2CC2 271570a_100011220607_100000036424 [0,1,0,1,0,0|2,0,0]=4 4553 B11R2.55 Fc1cccnc1C2CC2 271570a_100011220607_100000685392 [0,1,0,1,0,0|2,0,0]=4 4554 B11R2.55 Fc1ccncc1C2CC2 271570a_100011220607_100009820683 [0,1,0,1,0,0|2,0,0]=4 4555 B11R2.55 Fc1ncccc1C2CC2 271570a_100011220607_100009816115 [0,1,0,1,0,0|2,0,0]=4 4556 B11R2.55 Fc1nccnc1C2CC2 271570a_100011220607_200010125657 [0,1,0,1,0,0|1,0,0]=3 4557 B11R2.55 Nc1cccnc1C2CC2 271570a_100011220607_100000688686 [0,1,0,1,0,0|2,0,0]=4 4558 B11R2.55 Nc1ccncc1C2CC2 271570a_100011220607_100000047001 [0,1,0,1,0,0|2,0,0]=4 4559 B11R2.55 Nc1ncccc1C2CC2 271570a_100011220607_100000045569 [0,1,0,1,0,0|2,0,0]=4 4560 B11R2.55 Nc1nccnc1C2CC2 271570a_100011220607_100000747729 [0,1,0,1,0,0|1,0,0]=3 4561 B11R2.55 O=c1[nH]ccnc1C2CC2 271570a_100011220607_100000763361 [0,1,0,1,0,0|1,0,1]=4 4562 B11R2.55 Oc1cccnc1C2CC2 271570a_100011220607_100000034122 [0,1,0,1,0,0|2,0,0]=4 4563 B11R2.55 Oc1ncccc1C2CC2 271570a_203496583355_100009851976 [0,1,0,1,0,0|2,0,0]=4 4564 B11R2.106 Oc1ccnc2c1CCC2 271570a_203496583355_100000102697 [0,1,0,1,0,0|2,0,0]=4 4565 B11R2.106 Oc1nccc2c1CCN2 271570a_203496583355_100000104060 [0,1,0,1,0,0|2,0,0]=4 4566 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,1,0,1,0,0|2,0,0]=4 4567 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,1,0,1,0,0|2,0,0]=4 4568 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,1,0,1,0,0|2,0,0]=4 4569 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,1,0,1,0,0|2,0,0]=4 4570 B11R2.35 Brc1cccc(n1)C2CC2 271570a_100011220607_100000684672 [0,1,0,1,0,0|2,0,0]=4 4571 B11R2.35 Brc1cncc(c1)C2CC2 271570a_100011220607_100000728054 [0,1,0,1,0,0|2,0,0]=4 4572 B11R2.35 Cc1cccc(n1)C2CC2 271570a_100011220607_100000742759 [0,1,0,1,0,0|2,0,0]=4 4573 B11R2.35 Cc1ccnc(c1)C2CC2 271570a_100011220607_100000750283 [0,1,0,1,0,0|2,0,0]=4 4574 B11R2.35 Cc1cncc(c1)C2CC2 271570a_100011220607_100000760492 [0,1,0,1,0,0|2,0,0]=4 4575 B11R2.35 Cc1cncc(n1)C2CC2 271570a_100011220607_100009842155 [0,1,0,1,0,0|1,0,0]=3 4576 B11R2.35 Clc1ccnc(c1)C2CC2 271570a_100011220607_100010167805 [0,1,0,1,0,0|2,0,0]=4 4577 B11R2.35 Clc1cncc(c1)C2CC2 271570a_100011220607_100000049639 [0,1,0,1,0,0|2,0,0]=4 4578 B11R2.35 Fc1cccc(n1)C2CC2 271570a_100011220607_100009815982 [0,1,0,1,0,0|2,0,0]=4 4579 B11R2.35 Fc1ccnc(c1)C2CC2 271570a_100011220607_100009817058 [0,1,0,1,0,0|2,0,0]=4 4580 B11R2.35 Fc1cncc(c1)C2CC2 271570a_100011220607_100000744099 [0,1,0,1,0,0|2,0,0]=4 4581 B11R2.35 Fc1cncc(n1)C2CC2 271570a_100011220607_200009863489 [0,1,0,1,0,0|1,0,0]=3 4582 B11R2.35 Nc1cccc(n1)C2CC2 271570a_100011220607_100000740741 [0,1,0,1,0,0|2,0,0]=4 4583 B11R2.35 Nc1ccnc(c1)C2CC2 271570a_100011220607_100009814236 [0,1,0,1,0,0|2,0,0]=4 4584 B11R2.35 Nc1cncc(c1)C2CC2 271570a_100011220607_100000687067 [0,1,0,1,0,0|2,0,0]=4 4585 B11R2.35 Nc1cncc(n1)C2CC2 271570a_100011220607_100009819714 [0,1,0,1,0,0|1,0,0]=3 4586 B11R2.35 Oc1ccnc(c1)C2CC2 271570a_100011220607_100000762945 [0,1,0,1,0,0|2,0,0]=4 4587 B11R2.35 Oc1ccnc(c1)C2CC2 271570a_203496583355_100009820009 [0,1,0,1,0,0|2,0,0]=4 4588 B11R2.35 Oc1cncc(c1)C2CC2 271570a_100011220607_100000754920 [0,1,0,1,0,0|2,0,0]=4 4589 B11R2.35 Oc1cncc(c1)C2CC2 271570a_203496583355_200009866503 [0,1,0,1,0,0|2,0,0]=4 4590 B11R2.35 Oc1cncc(n1)C2CC2 271570a_100011220607_100011269956 [0,1,0,1,0,0|1,0,0]=3 4591 B11R2.35 [O-][n+]1ccnc(c1)C2CC2 271570a_100011220607_100009880115 [0,1,0,1,0,0|1,0,1]=4 4592 B11R2.1 Oc1csc2c1nccn2 271570a_203496583355_100010174841 [0,1,0,1,0,0|0,0,2]=4 4593 B11R2.239 c1cnc(cn1)N2CCC2 27a_100000754969_100000211759 [0,1,0,1,0,0|1,0,0]=3 4594 B11R2.238 c1ccc(nc1)SC2CC2 62a_100011216584_100000211595 [0,1,0,1,0,0|2,0,0]=4 4595 B11R2.238 c1cnc(cn1)NC2CC2 27a_100000212008_100000211759 [0,1,0,1,0,0|1,0,0]=3 4596 B11R2.238 c1cnc(cn1)SC2CC2 62a_100000211759_100000211595 [0,1,0,1,0,0|1,0,0]=3 4597 B11R2.238 c1cncc(c1)OC2CC2 34a_100000210849_100000211595 [0,1,0,1,0,0|2,0,0]=4 4598 B11R2.238 c1cncc(c1)SC2CC2 62a_100000210063_100000211595 [0,1,0,1,0,0|2,0,0]=4 4599 B7R1.1 CNc1ncns1 27a_100102657272_100000693119 [1,0,0,0,1,0|2,0,0]=4 4600 B7R1.1 COc1ccsc1 34a_100000106738_200000210301 [1,0,0,0,1,0|2,0,0]=4 4601 B7R1.1 COc1ccsc1 7a_100000106738_200000210301 [1,0,0,0,1,0|2,0,0]=4 4602 B7R1.1 CSc1c[nH]cn1 62a_100000756875_200000210301 [1,0,0,0,1,0|1,0,1]=4 4603 B7R1.1 CSc1c[nH]cn1 62a_200000210301_100000756875 [1,0,0,0,1,0|1,0,1]=4 4604 B7R1.1 CSc1cc[nH]n1 62a_100000062575_200000210301 [1,0,0,0,1,0|2,0,0]=4 4605 B7R1.1 CSc1cc[nH]n1 62a_200000210301_100000062575 [1,0,0,0,1,0|2,0,0]=4 4606 B7R1.1 CSc1ccco1 62a_100009814098_200000210301 [1,0,0,0,1,0|2,0,0]=4 4607 B7R1.1 CSc1ccco1 62a_200000210301_100009814098 [1,0,0,0,1,0|2,0,0]=4 4608 B7R1.1 CSc1cccs1 62a_100011215356_200000210301 [1,0,0,0,1,0|2,0,0]=4 4609 B7R1.1 CSc1cccs1 62a_200000210301_100011215356 [1,0,0,0,1,0|2,0,0]=4 4610 B7R1.1 CSc1ccoc1 62a_100011215275_200000210301 [1,0,0,0,1,0|2,0,0]=4 4611 B7R1.1 CSc1ccoc1 62a_200000210301_100011215275 [1,0,0,0,1,0|2,0,0]=4 4612 B7R1.1 CSc1ccon1 62a_100009818083_200000210301 [1,0,0,0,1,0|2,0,0]=4 4613 B7R1.1 CSc1ccon1 62a_200000210301_100009818083 [1,0,0,0,1,0|2,0,0]=4 4614 B7R1.1 CSc1ccsc1 62a_100000738268_200000210301 [1,0,0,0,1,0|2,0,0]=4 4615 B7R1.1 CSc1ccsc1 62a_200000210301_100000738268 [1,0,0,0,1,0|2,0,0]=4 4616 B7R1.1 CSc1ccsn1 62a_100009818082_200000210301 [1,0,0,0,1,0|2,0,0]=4 4617 B7R1.1 CSc1ccsn1 62a_200000210301_100009818082 [1,0,0,0,1,0|2,0,0]=4 4618 B7R1.1 CSc1cn[nH]c1 62a_100000238712_200000210301 [1,0,0,0,1,0|2,0,0]=4 4619 B7R1.1 CSc1cn[nH]c1 62a_200000210301_100000238712 [1,0,0,0,1,0|2,0,0]=4 4620 B7R1.1 CSc1cnco1 62a_100020591547_200000210301 [1,0,0,0,1,0|2,0,0]=4 4621 B7R1.1 CSc1cnco1 62a_200000210301_100020591547 [1,0,0,0,1,0|2,0,0]=4 4622 B7R1.1 CSc1cncs1 62a_100011934649_200000210301 [1,0,0,0,1,0|2,0,0]=4 4623 B7R1.1 CSc1cncs1 62a_200000210301_100011934649 [1,0,0,0,1,0|2,0,0]=4 4624 B7R1.1 CSc1cnoc1 62a_100009815712_200000210301 [1,0,0,0,1,0|2,0,0]=4 4625 B7R1.1 CSc1cnoc1 62a_200000210301_100009815712 [1,0,0,0,1,0|2,0,0]=4 4626 B7R1.1 CSc1cnsc1 62a_100009815736_200000210301 [1,0,0,0,1,0|2,0,0]=4 4627 B7R1.1 CSc1cnsc1 62a_200000210301_100009815736 [1,0,0,0,1,0|2,0,0]=4 4628 B7R1.1 CSc1cscn1 62a_100000751502_200000210301 [1,0,0,0,1,0|2,0,0]=4 4629 B7R1.1 CSc1cscn1 62a_200000210301_100000751502 [1,0,0,0,1,0|2,0,0]=4 4630 B7R1.1 CSc1nc[nH]n1 62a_100000761765_200000210301 [1,0,0,0,1,0|2,0,0]=4 4631 B7R1.1 CSc1nc[nH]n1 62a_200000210301_100000761765 [1,0,0,0,1,0|2,0,0]=4 4632 B7R1.1 CSc1ncc[nH]1 62a_100025796157_200000210301 [1,0,0,0,1,0|1,0,1]=4 4633 B7R1.1 CSc1ncc[nH]1 62a_200000210301_100025796157 [1,0,0,0,1,0|1,0,1]=4 4634 B7R1.1 CSc1ncco1 62a_100011787736_200000210301 [1,0,0,0,1,0|2,0,0]=4 4635 B7R1.1 CSc1ncco1 62a_200000210301_100011787736 [1,0,0,0,1,0|2,0,0]=4 4636 B7R1.1 CSc1nccs1 62a_100000211983_200000210301 [1,0,0,0,1,0|2,0,0]=4 4637 B7R1.1 CSc1nccs1 62a_200000210301_100000211983 [1,0,0,0,1,0|2,0,0]=4 4638 B7R1.1 CSc1ncns1 62a_100000693119_200000210301 [1,0,0,0,1,0|2,0,0]=4 4639 B7R1.1 CSc1ncns1 62a_200000210301_100000693119 [1,0,0,0,1,0|2,0,0]=4 4640 B7R1.1 [13CH3]Oc1ccsc1 34a_100000106738_200025704644 [1,0,0,0,1,0|2,0,0]=4 4641 B7R1.1 [13CH3]Oc1ccsc1 7a_100000106738_200025704644 [1,0,0,0,1,0|2,0,0]=4 4642 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_100000756875_200025704644 [1,0,0,0,1,0|1,0,1]=4 4643 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_200025704644_100000756875 [1,0,0,0,1,0|1,0,1]=4 4644 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_100000062575_200025704644 [1,0,0,0,1,0|2,0,0]=4 4645 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_200025704644_100000062575 [1,0,0,0,1,0|2,0,0]=4 4646 B7R1.1 [13CH3]Sc1ccco1 62a_100009814098_200025704644 [1,0,0,0,1,0|2,0,0]=4 4647 B7R1.1 [13CH3]Sc1ccco1 62a_200025704644_100009814098 [1,0,0,0,1,0|2,0,0]=4 4648 B7R1.1 [13CH3]Sc1cccs1 62a_100011215356_200025704644 [1,0,0,0,1,0|2,0,0]=4 4649 B7R1.1 [13CH3]Sc1cccs1 62a_200025704644_100011215356 [1,0,0,0,1,0|2,0,0]=4 4650 B7R1.1 [13CH3]Sc1ccoc1 62a_100011215275_200025704644 [1,0,0,0,1,0|2,0,0]=4 4651 B7R1.1 [13CH3]Sc1ccoc1 62a_200025704644_100011215275 [1,0,0,0,1,0|2,0,0]=4 4652 B7R1.1 [13CH3]Sc1ccon1 62a_100009818083_200025704644 [1,0,0,0,1,0|2,0,0]=4 4653 B7R1.1 [13CH3]Sc1ccon1 62a_200025704644_100009818083 [1,0,0,0,1,0|2,0,0]=4 4654 B7R1.1 [13CH3]Sc1ccsc1 62a_100000738268_200025704644 [1,0,0,0,1,0|2,0,0]=4 4655 B7R1.1 [13CH3]Sc1ccsc1 62a_200025704644_100000738268 [1,0,0,0,1,0|2,0,0]=4 4656 B7R1.1 [13CH3]Sc1ccsn1 62a_100009818082_200025704644 [1,0,0,0,1,0|2,0,0]=4 4657 B7R1.1 [13CH3]Sc1ccsn1 62a_200025704644_100009818082 [1,0,0,0,1,0|2,0,0]=4 4658 B7R1.1 [13CH3]Sc1cn[nH]c1 62a_100000238712_200025704644 [1,0,0,0,1,0|2,0,0]=4 4659 B7R1.1 [13CH3]Sc1cn[nH]c1 62a_200025704644_100000238712 [1,0,0,0,1,0|2,0,0]=4 4660 B7R1.1 [13CH3]Sc1cnco1 62a_100020591547_200025704644 [1,0,0,0,1,0|2,0,0]=4 4661 B7R1.1 [13CH3]Sc1cnco1 62a_200025704644_100020591547 [1,0,0,0,1,0|2,0,0]=4 4662 B7R1.1 [13CH3]Sc1cncs1 62a_100011934649_200025704644 [1,0,0,0,1,0|2,0,0]=4 4663 B7R1.1 [13CH3]Sc1cncs1 62a_200025704644_100011934649 [1,0,0,0,1,0|2,0,0]=4 4664 B7R1.1 [13CH3]Sc1cnoc1 62a_100009815712_200025704644 [1,0,0,0,1,0|2,0,0]=4 4665 B7R1.1 [13CH3]Sc1cnoc1 62a_200025704644_100009815712 [1,0,0,0,1,0|2,0,0]=4 4666 B7R1.1 [13CH3]Sc1cnsc1 62a_100009815736_200025704644 [1,0,0,0,1,0|2,0,0]=4 4667 B7R1.1 [13CH3]Sc1cnsc1 62a_200025704644_100009815736 [1,0,0,0,1,0|2,0,0]=4 4668 B7R1.1 [13CH3]Sc1cscn1 62a_100000751502_200025704644 [1,0,0,0,1,0|2,0,0]=4 4669 B7R1.1 [13CH3]Sc1cscn1 62a_200025704644_100000751502 [1,0,0,0,1,0|2,0,0]=4 4670 B7R1.1 [13CH3]Sc1nc[nH]n1 62a_100000761765_200025704644 [1,0,0,0,1,0|2,0,0]=4 4671 B7R1.1 [13CH3]Sc1nc[nH]n1 62a_200025704644_100000761765 [1,0,0,0,1,0|2,0,0]=4 4672 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_100025796157_200025704644 [1,0,0,0,1,0|1,0,1]=4 4673 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_200025704644_100025796157 [1,0,0,0,1,0|1,0,1]=4 4674 B7R1.1 [13CH3]Sc1ncco1 62a_100011787736_200025704644 [1,0,0,0,1,0|2,0,0]=4 4675 B7R1.1 [13CH3]Sc1ncco1 62a_200025704644_100011787736 [1,0,0,0,1,0|2,0,0]=4 4676 B7R1.1 [13CH3]Sc1nccs1 62a_100000211983_200025704644 [1,0,0,0,1,0|2,0,0]=4 4677 B7R1.1 [13CH3]Sc1nccs1 62a_200025704644_100000211983 [1,0,0,0,1,0|2,0,0]=4 4678 B7R1.1 [13CH3]Sc1ncns1 62a_100000693119_200025704644 [1,0,0,0,1,0|2,0,0]=4 4679 B7R1.1 [13CH3]Sc1ncns1 62a_200025704644_100000693119 [1,0,0,0,1,0|2,0,0]=4